Loop Id: 14221 | Module: libgromacs_mpi.so.9.0.0 | Source: calc_verletbuf.cpp:606-849 [...] | Coverage: 1.75% |
---|
Loop Id: 14221 | Module: libgromacs_mpi.so.9.0.0 | Source: calc_verletbuf.cpp:606-849 [...] | Coverage: 1.75% |
---|
0xac93b0 VMOVSS %XMM3,-0x2c(%RBP) [4] |
0xac93b5 VMOVSD %XMM4,-0x48(%RBP) [4] |
0xac93ba CALL fa66c0 <@plt_start@+0x3210> |
0xac93bf VMOVSD -0x48(%RBP),%XMM4 [4] |
0xac93c4 VMOVSS -0x2c(%RBP),%XMM3 [4] |
0xac93c9 VMOVSS -0x3c(%RBP),%XMM2 [4] |
0xac93ce MOV -0x68(%RBP),%R8 [4] |
0xac93d2 MOV -0x60(%RBP),%R9 [4] |
0xac93d6 VMOVSS -0x38(%RBP),%XMM7 [4] |
0xac93db VMOVSD -0x50(%RBP),%XMM5 [4] |
0xac93e0 VMOVSS -0x34(%RBP),%XMM1 [4] |
0xac93e5 VADDSS %XMM3,%XMM1,%XMM1 |
0xac93e9 VCVTSS2SD %XMM1,%XMM1,%XMM1 |
0xac93ed VMULSD %XMM1,%XMM4,%XMM1 |
0xac93f1 VCVTSD2SS %XMM1,%XMM1,%XMM1 |
0xac93f5 VADDSS %XMM2,%XMM0,%XMM0 |
0xac93f9 VMULSS %XMM0,%XMM0,%XMM0 |
0xac93fd VCVTSS2SD %XMM0,%XMM0,%XMM0 |
0xac9401 VMULSD -0x76bb31(%RIP),%XMM0,%XMM0 [7] |
0xac9409 VMULSD -0x98(%RBP),%XMM0,%XMM0 [4] |
0xac9411 VCVTSS2SD %XMM1,%XMM1,%XMM1 |
0xac9415 VDIVSD -0x90(%RBP),%XMM0,%XMM0 [4] |
0xac941d VMULSD %XMM1,%XMM0,%XMM0 |
0xac9421 VCVTSD2SS %XMM0,%XMM0,%XMM0 |
0xac9425 VANDPS -0x76d06b(%RIP){1to4},%XMM0,%XMM0 [7] |
0xac942f VCVTSS2SD %XMM0,%XMM0,%XMM0 |
0xac9433 VADDSD %XMM0,%XMM5,%XMM5 |
0xac9437 ADD $0x20,%R13 |
0xac943b CMP %R14,-0xa8(%RBP) [4] |
0xac9442 JE ac8f80 |
0xac9448 MOVSX 0xa(%R13),%EAX [6] |
0xac944d VCVTSI2SS %EAX,%XMM8,%XMM2 |
0xac9451 VMULSS -0x76cd9d(%RIP),%XMM2,%XMM0 [7] |
0xac9459 MOVSX (%R13),%EAX [6] |
0xac945e VCVTSI2SS %EAX,%XMM8,%XMM1 |
0xac9462 VUCOMISS %XMM0,%XMM1 |
0xac9466 VMOVSS 0x10(%R13),%XMM3 [6] |
0xac946c VMOVSD %XMM5,-0x50(%RBP) [4] |
0xac9471 JBE ac9500 |
0xac9477 VMULSS %XMM2,%XMM3,%XMM2 |
0xac947b VMULSS %XMM1,%XMM3,%XMM3 |
0xac947f VMOVSS -0x76d2fb(%RIP),%XMM6 [7] |
0xac9487 VDIVSS %XMM3,%XMM6,%XMM4 |
0xac948b VDIVSS %XMM2,%XMM6,%XMM5 |
0xac948f VADDSS %XMM4,%XMM5,%XMM4 |
0xac9493 VMULSS %XMM4,%XMM2,%XMM2 |
0xac9497 VDIVSS %XMM2,%XMM6,%XMM2 |
0xac949b VMULSS %XMM7,%XMM2,%XMM5 |
0xac949f VMULSS %XMM5,%XMM3,%XMM3 |
0xac94a3 MOVSX 0xc(%R13),%EAX [6] |
0xac94a8 VCVTSI2SS %EAX,%XMM8,%XMM5 |
0xac94ac VMULSS 0x18(%R13),%XMM5,%XMM5 [6] |
0xac94b2 VMULSS %XMM2,%XMM5,%XMM2 |
0xac94b6 VMULSS %XMM2,%XMM2,%XMM2 |
0xac94ba VDIVSS %XMM2,%XMM3,%XMM3 |
0xac94be VMOVSS -0x76d02a(%RIP),%XMM5 [7] |
0xac94c6 VMINSS %XMM3,%XMM5,%XMM3 |
0xac94ca VMULSS %XMM3,%XMM2,%XMM2 |
0xac94ce VMOVAPS %XMM6,%XMM5 |
0xac94d2 VFMADD231SS -0x76d2af(%RIP),%XMM3,%XMM5 [7] |
0xac94db VMULSS %XMM3,%XMM3,%XMM3 |
0xac94df VFMADD132SS -0x76ccc8(%RIP),%XMM5,%XMM3 [7] |
0xac94e8 VDIVSS %XMM3,%XMM2,%XMM2 |
0xac94ec VDIVSS %XMM4,%XMM7,%XMM3 |
0xac94f0 JMP ac950c |
0xac9500 VMULSS %XMM1,%XMM3,%XMM2 |
0xac9504 VMULSS %XMM7,%XMM2,%XMM3 |
0xac9508 VXORPS %XMM2,%XMM2,%XMM2 |
0xac950c VMOVSS %XMM2,-0x48(%RBP) [4] |
0xac9511 XOR %ESI,%ESI |
0xac9513 VUCOMISS %XMM0,%XMM1 |
0xac9517 SETA %SIL |
0xac951b MOVSXD 0x4(%R15),%RAX [8] |
0xac951f MOVSXD (%R12),%RCX [5] |
0xac9523 IMUL %RAX,%RCX |
0xac9527 MOVSXD 0x4(%R13),%RAX [6] |
0xac952b ADD %RCX,%RAX |
0xac952e MOV 0x20(%R12),%RCX [5] |
0xac9533 LEA (%RAX,%RAX,2),%RAX |
0xac9537 SAL $0x4,%RAX |
0xac953b VBROADCASTSS 0x4(%RCX,%RAX,1),%XMM0 [3] |
0xac9542 VBROADCASTSS (%RCX,%RAX,1),%XMM1 [3] |
0xac9548 VMULPS (%R8),%XMM0,%XMM0 [1] |
0xac954d VFMADD231PS (%R9),%XMM1,%XMM0 [2] |
0xac9552 VADDSS -0x84(%RBP),%XMM2,%XMM1 [4] |
0xac955a VMOVAPS %XMM0,-0xc0(%RBP) [4] |
0xac9562 VADDSS %XMM3,%XMM1,%XMM0 |
0xac9566 VMOVSS %XMM0,-0x2c(%RBP) [4] |
0xac956b MOVSX 0xa(%R15),%EAX [8] |
0xac9570 VCVTSI2SS %EAX,%XMM8,%XMM3 |
0xac9574 VMOVSS -0x76cec0(%RIP),%XMM1 [7] |
0xac957c VMULSS %XMM1,%XMM3,%XMM3 |
0xac9580 MOVSX (%R15),%EAX [8] |
0xac9584 VCVTSI2SS %EAX,%XMM8,%XMM1 |
0xac9588 XOR %EDI,%EDI |
0xac958a VUCOMISS %XMM3,%XMM1 |
0xac958e SETA %DIL |
0xac9592 VMOVSS -0x30(%RBP),%XMM1 [4] |
0xac9597 VMOVSS -0x58(%RBP),%XMM3 [4] |
0xac959c LEA -0xc0(%RBP),%RDX |
0xac95a3 CALL ac9c70 <_ZL19energyDriftAtomPairbbffffPK17pot_derivatives_t> |
0xac95a8 MOVSX 0x8(%R15),%EAX [8] |
0xac95ad VCVTSI2SS %EAX,%XMM8,%XMM1 |
0xac95b1 VMULSS 0x14(%R15),%XMM1,%XMM1 [8] |
0xac95b7 MOVSX 0x8(%R13),%EAX [6] |
0xac95bc VCVTSI2SS %EAX,%XMM8,%XMM2 |
0xac95c0 VMULSS 0x14(%R13),%XMM2,%XMM2 [6] |
0xac95c6 VMOVSD (%RBX),%XMM3 [10] |
0xac95ca VBROADCASTSS %XMM1,%XMM4 |
0xac95cf VMULPS %XMM4,%XMM3,%XMM3 |
0xac95d3 VBROADCASTSS %XMM2,%XMM4 |
0xac95d8 VMULPS %XMM3,%XMM4,%XMM3 |
0xac95dc VMOVLPS %XMM3,-0x80(%RBP) [4] |
0xac95e1 VMULSS 0x8(%RBX),%XMM1,%XMM1 [10] |
0xac95e6 VMULSS %XMM1,%XMM2,%XMM1 |
0xac95ea VMOVSS %XMM1,-0x78(%RBP) [4] |
0xac95ef MOVL $0,-0x74(%RBP) [4] |
0xac95f6 MOVSX 0xa(%R15),%EAX [8] |
0xac95fb VCVTSI2SS %EAX,%XMM8,%XMM1 |
0xac95ff VMOVSS -0x76cf4b(%RIP),%XMM3 [7] |
0xac9607 VMULSS %XMM3,%XMM1,%XMM1 |
0xac960b MOVSX (%R15),%EAX [8] |
0xac960f VCVTSI2SS %EAX,%XMM8,%XMM2 |
0xac9613 XOR %EDI,%EDI |
0xac9615 VUCOMISS %XMM1,%XMM2 |
0xac9619 SETA %DIL |
0xac961d VMOVSS %XMM0,-0x34(%RBP) [4] |
0xac9622 MOVSX 0xa(%R13),%EAX [6] |
0xac9627 VCVTSI2SS %EAX,%XMM8,%XMM0 |
0xac962b VMULSS %XMM3,%XMM0,%XMM0 |
0xac962f MOVSX (%R13),%EAX [6] |
0xac9634 VCVTSI2SS %EAX,%XMM8,%XMM1 |
0xac9638 XOR %ESI,%ESI |
0xac963a VUCOMISS %XMM0,%XMM1 |
0xac963e SETA %SIL |
0xac9642 VMOVSS -0x2c(%RBP),%XMM0 [4] |
0xac9647 VMOVSS -0x30(%RBP),%XMM1 [4] |
0xac964c VMOVSS -0x48(%RBP),%XMM2 [4] |
0xac9651 VMOVSS -0x54(%RBP),%XMM3 [4] |
0xac9656 LEA -0x80(%RBP),%RDX |
0xac965a CALL ac9c70 <_ZL19energyDriftAtomPairbbffffPK17pot_derivatives_t> |
0xac965f VMOVAPD %XMM0,%XMM3 |
0xac9663 MOV -0xa0(%RBP),%RAX [4] |
0xac966a MOV (%RAX),%EAX [9] |
0xac966c VCVTSI2SD %EAX,%XMM8,%XMM0 |
0xac9670 SUB $0x1,%R14 |
0xac9674 JAE ac96a0 |
0xac9676 DEC %EAX |
0xac9678 VCVTSI2SD %EAX,%XMM8,%XMM1 |
0xac967c VMULSD %XMM1,%XMM0,%XMM0 |
0xac9680 VMULSD -0x76c528(%RIP),%XMM0,%XMM4 [7] |
0xac9688 VMOVSS -0x2c(%RBP),%XMM0 [4] |
0xac968d VUCOMISS -0x76d329(%RIP),%XMM0 [7] |
0xac9695 JB ac93b0 |
0xac969b JMP ac96bd |
0xac96a0 VCVTSI2SDL 0x1c(%R13),%XMM8,%XMM1 [6] |
0xac96a6 VMULSD %XMM1,%XMM0,%XMM4 |
0xac96aa VMOVSS -0x2c(%RBP),%XMM0 [4] |
0xac96af VUCOMISS -0x76d34b(%RIP),%XMM0 [7] |
0xac96b7 JB ac93b0 |
0xac96bd VSQRTSS %XMM0,%XMM0,%XMM0 |
0xac96c1 JMP ac93c9 |
/usr/lib/gcc/x86_64-redhat-linux/11/../../../../include/c++/11/bits/std_abs.h: 76 - 76 |
-------------------------------------------------------------------------------- |
76: { return __builtin_fabsf(__x); } |
/home/eoseret/gromacs-2024.2/src/gromacs/mdlib/calc_verletbuf.cpp: 606 - 849 |
-------------------------------------------------------------------------------- |
606: 1 / (prop.constraintInvMass() * (1 / prop.invMass() + 1 / prop.constraintInvMass())); |
607: real sigma2_rot = kT_fac * massFraction * prop.invMass(); |
608: |
609: /* The distance from the atom to the COM, i.e. the rotational arm */ |
610: real comDistance = prop.constraintLength() * massFraction; |
611: |
612: /* The variance relative to the arm */ |
613: real sigma2_rel = sigma2_rot / gmx::square(comDistance); |
[...] |
642: sigma2_rel = std::min(sigma2_rel, 1 / std::sqrt(b)); |
643: |
644: /* Compute the approximate sigma^2 for 2D motion due to the rotation */ |
645: *sigma2_2d = |
646: gmx::square(comDistance) * sigma2_rel / (1 + a * sigma2_rel + b * gmx::square(sigma2_rel)); |
647: |
648: /* The constrained atom also moves (in 3D) with the COM of both atoms */ |
649: *sigma2_3d = kT_fac / (1 / prop.invMass() + 1 / prop.constraintInvMass()); |
650: } |
651: |
652: static void get_atom_sigma2(real kT_fac, const AtomNonbondedAndKineticProperties& prop, real* sigma2_2d, real* sigma2_3d) |
653: { |
654: if (prop.hasConstraint()) |
[...] |
663: *sigma2_3d = kT_fac * prop.invMass(); |
[...] |
798: for (gmx::Index j = i; j < att.ssize(); j++) |
[...] |
806: real s2 = s2i_2d + s2i_3d + s2j_2d + s2j_3d; |
807: |
808: // Set V, -V', V'' and -V''' at the cut-off for LJ |
809: real c6 = ffp->iparams[propI.type() * ffp->atnr + propJ.type()].lj.c6; |
810: real c12 = ffp->iparams[propI.type() * ffp->atnr + propJ.type()].lj.c12; |
811: pot_derivatives_t lj; |
812: lj.pot = c6 * ljDisp.pot + c12 * ljRep.pot; |
813: lj.md1 = c6 * ljDisp.md1 + c12 * ljRep.md1; |
814: lj.d2 = c6 * ljDisp.d2 + c12 * ljRep.d2; |
815: lj.md3 = c6 * ljDisp.md3 + c12 * ljRep.md3; |
816: |
817: real pot_lj = energyDriftAtomPair( |
818: propI.hasConstraint(), propJ.hasConstraint(), s2, s2i_2d, s2j_2d, rlist - rlj, &lj); |
819: |
820: // Set -V' and V'' at the cut-off for Coulomb |
821: pot_derivatives_t elec_qq; |
822: elec_qq.pot = elec.pot * propI.charge() * propJ.charge(); |
823: elec_qq.md1 = elec.md1 * propI.charge() * propJ.charge(); |
824: elec_qq.d2 = elec.d2 * propI.charge() * propJ.charge(); |
825: elec_qq.md3 = 0; |
826: |
827: real pot_q = energyDriftAtomPair( |
[...] |
835: if (j == i) |
836: { |
837: pot *= static_cast<double>(att[i].n) * (att[i].n - 1) / 2; |
838: } |
839: else |
840: { |
841: pot *= static_cast<double>(att[i].n) * att[j].n; |
842: } |
843: /* We need the line density to get the energy drift of the system. |
844: * The effective average r^2 is close to (rlist+sigma)^2. |
845: */ |
846: pot *= 4 * M_PI * gmx::square(rlist + std::sqrt(s2)) * effectiveAtomDensity / totNumAtoms; |
847: |
848: /* Add the unsigned drift to avoid cancellation of errors */ |
849: drift_tot += std::abs(pot); |
/home/eoseret/gromacs-2024.2/api/legacy/include/gromacs/math/functions.h: 321 - 321 |
-------------------------------------------------------------------------------- |
321: return x * x; |
/home/eoseret/gromacs-2024.2/src/gromacs/mdlib/calc_verletbuf.h: 263 - 291 |
-------------------------------------------------------------------------------- |
263: real invMass() const { return invMassScale_ * invMass_; } |
264: |
265: // Returns the atom type |
266: int type() const { return type_; } |
267: |
268: // Returns the charge |
269: real charge() const { return chargeScale_ * charge_; } |
[...] |
284: return c_massRatioThreshold * constraintInvMass_ < invMass_; |
285: } |
286: |
287: // Returns 1/mass for the atom connected by a constraint with the largest mass |
288: real constraintInvMass() const { return invMassScale_ * constraintInvMass_; } |
289: |
290: // Returns the length of the constraint to the atom with the largest mass |
291: real constraintLength() const { return constraintLengthScale_ * constraintLength_; } |
/usr/lib/gcc/x86_64-redhat-linux/11/../../../../include/c++/11/bits/stl_vector.h: 1064 - 1064 |
-------------------------------------------------------------------------------- |
1064: return *(this->_M_impl._M_start + __n); |
Coverage (%) | Name | Source Location | Module |
---|---|---|---|
►50.94+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1455 | libgromacs_mpi.so.9.0.0 |
○ | increaseNstlist(_IO_FILE*, t_c[...] | pairlist_tuning.cpp:311 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:607 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►15.09+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1455 | libgromacs_mpi.so.9.0.0 |
○ | setupDynamicPairlistPruning(gm[...] | pairlist_tuning.cpp:555 | libgromacs_mpi.so.9.0.0 |
○ | Nbnxm::init_nb_verlet(gmx::MDL[...] | nbnxm_setup.cpp:431 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:1859 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►15.09+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1455 | libgromacs_mpi.so.9.0.0 |
○ | setupDynamicPairlistPruning(gm[...] | pairlist_tuning.cpp:737 | libgromacs_mpi.so.9.0.0 |
○ | Nbnxm::init_nb_verlet(gmx::MDL[...] | nbnxm_setup.cpp:431 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:1859 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►3.77+ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1439 | libgromacs_mpi.so.9.0.0 |
○ | setupDynamicPairlistPruning(gm[...] | pairlist_tuning.cpp:737 | libgromacs_mpi.so.9.0.0 |
○ | Nbnxm::init_nb_verlet(gmx::MDL[...] | nbnxm_setup.cpp:431 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:1859 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►3.77+ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1439 | libgromacs_mpi.so.9.0.0 |
○ | increaseNstlist(_IO_FILE*, t_c[...] | pairlist_tuning.cpp:311 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:607 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►3.77+ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1439 | libgromacs_mpi.so.9.0.0 |
○ | setupDynamicPairlistPruning(gm[...] | pairlist_tuning.cpp:555 | libgromacs_mpi.so.9.0.0 |
○ | Nbnxm::init_nb_verlet(gmx::MDL[...] | nbnxm_setup.cpp:431 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:1859 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►1.89+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | verletBufferPressureError(gmx_[...] | calc_verletbuf.cpp:1537 | libgromacs_mpi.so.9.0.0 |
○ | printNbnxmPressureError(gmx::M[...] | pairlist_tuning.cpp:795 | libgromacs_mpi.so.9.0.0 |
○ | Nbnxm::init_nb_verlet(gmx::MDL[...] | nbnxm_setup.cpp:436 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:1859 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►1.89+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1455 | libgromacs_mpi.so.9.0.0 |
○ | increaseNstlist(_IO_FILE*, t_c[...] | pairlist_tuning.cpp:284 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:607 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►1.89+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1455 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:573 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►1.89+ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1439 | libgromacs_mpi.so.9.0.0 |
○ | setupDynamicPairlistPruning(gm[...] | pairlist_tuning.cpp:757 | libgromacs_mpi.so.9.0.0 |
○ | Nbnxm::init_nb_verlet(gmx::MDL[...] | nbnxm_setup.cpp:431 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:1859 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 |
Coverage (%) | Name | Source Location | Module |
---|---|---|---|
►48.62+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1455 | libgromacs_mpi.so.9.0.0 |
○ | increaseNstlist(_IO_FILE*, t_c[...] | pairlist_tuning.cpp:311 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:607 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►18.35+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1455 | libgromacs_mpi.so.9.0.0 |
○ | setupDynamicPairlistPruning(gm[...] | pairlist_tuning.cpp:737 | libgromacs_mpi.so.9.0.0 |
○ | Nbnxm::init_nb_verlet(gmx::MDL[...] | nbnxm_setup.cpp:431 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:1859 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►10.09+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1455 | libgromacs_mpi.so.9.0.0 |
○ | setupDynamicPairlistPruning(gm[...] | pairlist_tuning.cpp:555 | libgromacs_mpi.so.9.0.0 |
○ | Nbnxm::init_nb_verlet(gmx::MDL[...] | nbnxm_setup.cpp:431 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:1859 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►7.34+ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1439 | libgromacs_mpi.so.9.0.0 |
○ | increaseNstlist(_IO_FILE*, t_c[...] | pairlist_tuning.cpp:311 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:607 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►6.42+ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1439 | libgromacs_mpi.so.9.0.0 |
○ | setupDynamicPairlistPruning(gm[...] | pairlist_tuning.cpp:555 | libgromacs_mpi.so.9.0.0 |
○ | Nbnxm::init_nb_verlet(gmx::MDL[...] | nbnxm_setup.cpp:431 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:1859 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►2.75+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1455 | libgromacs_mpi.so.9.0.0 |
○ | increaseNstlist(_IO_FILE*, t_c[...] | pairlist_tuning.cpp:284 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:607 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►2.75+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | verletBufferPressureError(gmx_[...] | calc_verletbuf.cpp:1537 | libgromacs_mpi.so.9.0.0 |
○ | printNbnxmPressureError(gmx::M[...] | pairlist_tuning.cpp:795 | libgromacs_mpi.so.9.0.0 |
○ | Nbnxm::init_nb_verlet(gmx::MDL[...] | nbnxm_setup.cpp:436 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:1859 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 |
Coverage (%) | Name | Source Location | Module |
---|---|---|---|
►42.25+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1455 | libgromacs_mpi.so.9.0.0 |
○ | increaseNstlist(_IO_FILE*, t_c[...] | pairlist_tuning.cpp:311 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:607 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►17.84+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1455 | libgromacs_mpi.so.9.0.0 |
○ | setupDynamicPairlistPruning(gm[...] | pairlist_tuning.cpp:737 | libgromacs_mpi.so.9.0.0 |
○ | Nbnxm::init_nb_verlet(gmx::MDL[...] | nbnxm_setup.cpp:431 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:1859 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►12.68+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1455 | libgromacs_mpi.so.9.0.0 |
○ | setupDynamicPairlistPruning(gm[...] | pairlist_tuning.cpp:555 | libgromacs_mpi.so.9.0.0 |
○ | Nbnxm::init_nb_verlet(gmx::MDL[...] | nbnxm_setup.cpp:431 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:1859 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►5.63+ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1439 | libgromacs_mpi.so.9.0.0 |
○ | increaseNstlist(_IO_FILE*, t_c[...] | pairlist_tuning.cpp:311 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:607 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►5.63+ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1439 | libgromacs_mpi.so.9.0.0 |
○ | setupDynamicPairlistPruning(gm[...] | pairlist_tuning.cpp:555 | libgromacs_mpi.so.9.0.0 |
○ | Nbnxm::init_nb_verlet(gmx::MDL[...] | nbnxm_setup.cpp:431 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:1859 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►3.29+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1455 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:573 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►2.82+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1455 | libgromacs_mpi.so.9.0.0 |
○ | setupDynamicPairlistPruning(gm[...] | pairlist_tuning.cpp:757 | libgromacs_mpi.so.9.0.0 |
○ | Nbnxm::init_nb_verlet(gmx::MDL[...] | nbnxm_setup.cpp:431 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:1859 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►2.35+ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1439 | libgromacs_mpi.so.9.0.0 |
○ | setupDynamicPairlistPruning(gm[...] | pairlist_tuning.cpp:737 | libgromacs_mpi.so.9.0.0 |
○ | Nbnxm::init_nb_verlet(gmx::MDL[...] | nbnxm_setup.cpp:431 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:1859 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►2.35+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1455 | libgromacs_mpi.so.9.0.0 |
○ | increaseNstlist(_IO_FILE*, t_c[...] | pairlist_tuning.cpp:284 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:607 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►1.88+ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1439 | libgromacs_mpi.so.9.0.0 |
○ | setupDynamicPairlistPruning(gm[...] | pairlist_tuning.cpp:757 | libgromacs_mpi.so.9.0.0 |
○ | Nbnxm::init_nb_verlet(gmx::MDL[...] | nbnxm_setup.cpp:431 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:1859 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►1.41+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | verletBufferPressureError(gmx_[...] | calc_verletbuf.cpp:1537 | libgromacs_mpi.so.9.0.0 |
○ | printNbnxmPressureError(gmx::M[...] | pairlist_tuning.cpp:795 | libgromacs_mpi.so.9.0.0 |
○ | Nbnxm::init_nb_verlet(gmx::MDL[...] | nbnxm_setup.cpp:436 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:1859 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 |
Coverage (%) | Name | Source Location | Module |
---|---|---|---|
►47.37+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1455 | libgromacs_mpi.so.9.0.0 |
○ | increaseNstlist(_IO_FILE*, t_c[...] | pairlist_tuning.cpp:311 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:607 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►16.70+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1455 | libgromacs_mpi.so.9.0.0 |
○ | setupDynamicPairlistPruning(gm[...] | pairlist_tuning.cpp:737 | libgromacs_mpi.so.9.0.0 |
○ | Nbnxm::init_nb_verlet(gmx::MDL[...] | nbnxm_setup.cpp:431 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:1859 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►11.90+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1455 | libgromacs_mpi.so.9.0.0 |
○ | setupDynamicPairlistPruning(gm[...] | pairlist_tuning.cpp:555 | libgromacs_mpi.so.9.0.0 |
○ | Nbnxm::init_nb_verlet(gmx::MDL[...] | nbnxm_setup.cpp:431 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:1859 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►7.32+ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1439 | libgromacs_mpi.so.9.0.0 |
○ | setupDynamicPairlistPruning(gm[...] | pairlist_tuning.cpp:555 | libgromacs_mpi.so.9.0.0 |
○ | Nbnxm::init_nb_verlet(gmx::MDL[...] | nbnxm_setup.cpp:431 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:1859 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►3.66+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1455 | libgromacs_mpi.so.9.0.0 |
○ | setupDynamicPairlistPruning(gm[...] | pairlist_tuning.cpp:757 | libgromacs_mpi.so.9.0.0 |
○ | Nbnxm::init_nb_verlet(gmx::MDL[...] | nbnxm_setup.cpp:431 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:1859 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►3.66+ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1439 | libgromacs_mpi.so.9.0.0 |
○ | increaseNstlist(_IO_FILE*, t_c[...] | pairlist_tuning.cpp:311 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:607 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►2.75+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1455 | libgromacs_mpi.so.9.0.0 |
○ | increaseNstlist(_IO_FILE*, t_c[...] | pairlist_tuning.cpp:284 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:607 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►2.06+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | verletBufferPressureError(gmx_[...] | calc_verletbuf.cpp:1537 | libgromacs_mpi.so.9.0.0 |
○ | printNbnxmPressureError(gmx::M[...] | pairlist_tuning.cpp:795 | libgromacs_mpi.so.9.0.0 |
○ | Nbnxm::init_nb_verlet(gmx::MDL[...] | nbnxm_setup.cpp:436 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:1859 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►1.60+ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1439 | libgromacs_mpi.so.9.0.0 |
○ | setupDynamicPairlistPruning(gm[...] | pairlist_tuning.cpp:757 | libgromacs_mpi.so.9.0.0 |
○ | Nbnxm::init_nb_verlet(gmx::MDL[...] | nbnxm_setup.cpp:431 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:1859 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►1.37+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1455 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:573 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 |
Coverage (%) | Name | Source Location | Module |
---|---|---|---|
►45.77+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1455 | libgromacs_mpi.so.9.0.0 |
○ | increaseNstlist(_IO_FILE*, t_c[...] | pairlist_tuning.cpp:311 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:607 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►18.55+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1455 | libgromacs_mpi.so.9.0.0 |
○ | setupDynamicPairlistPruning(gm[...] | pairlist_tuning.cpp:737 | libgromacs_mpi.so.9.0.0 |
○ | Nbnxm::init_nb_verlet(gmx::MDL[...] | nbnxm_setup.cpp:431 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:1859 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►13.39+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1455 | libgromacs_mpi.so.9.0.0 |
○ | setupDynamicPairlistPruning(gm[...] | pairlist_tuning.cpp:555 | libgromacs_mpi.so.9.0.0 |
○ | Nbnxm::init_nb_verlet(gmx::MDL[...] | nbnxm_setup.cpp:431 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:1859 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►6.48+ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1439 | libgromacs_mpi.so.9.0.0 |
○ | setupDynamicPairlistPruning(gm[...] | pairlist_tuning.cpp:555 | libgromacs_mpi.so.9.0.0 |
○ | Nbnxm::init_nb_verlet(gmx::MDL[...] | nbnxm_setup.cpp:431 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:1859 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►4.61+ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1439 | libgromacs_mpi.so.9.0.0 |
○ | increaseNstlist(_IO_FILE*, t_c[...] | pairlist_tuning.cpp:311 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:607 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►2.63+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1455 | libgromacs_mpi.so.9.0.0 |
○ | setupDynamicPairlistPruning(gm[...] | pairlist_tuning.cpp:757 | libgromacs_mpi.so.9.0.0 |
○ | Nbnxm::init_nb_verlet(gmx::MDL[...] | nbnxm_setup.cpp:431 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:1859 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►1.54+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1455 | libgromacs_mpi.so.9.0.0 |
○ | increaseNstlist(_IO_FILE*, t_c[...] | pairlist_tuning.cpp:284 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:607 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►1.54+ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1439 | libgromacs_mpi.so.9.0.0 |
○ | setupDynamicPairlistPruning(gm[...] | pairlist_tuning.cpp:737 | libgromacs_mpi.so.9.0.0 |
○ | Nbnxm::init_nb_verlet(gmx::MDL[...] | nbnxm_setup.cpp:431 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:1859 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►1.54+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | verletBufferPressureError(gmx_[...] | calc_verletbuf.cpp:1537 | libgromacs_mpi.so.9.0.0 |
○ | printNbnxmPressureError(gmx::M[...] | pairlist_tuning.cpp:795 | libgromacs_mpi.so.9.0.0 |
○ | Nbnxm::init_nb_verlet(gmx::MDL[...] | nbnxm_setup.cpp:436 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:1859 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►1.32+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1455 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:573 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►1.10+ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1439 | libgromacs_mpi.so.9.0.0 |
○ | increaseNstlist(_IO_FILE*, t_c[...] | pairlist_tuning.cpp:284 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:607 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 |
Coverage (%) | Name | Source Location | Module |
---|---|---|---|
►57.26+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1455 | libgromacs_mpi.so.9.0.0 |
○ | increaseNstlist(_IO_FILE*, t_c[...] | pairlist_tuning.cpp:311 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:607 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►12.12+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1455 | libgromacs_mpi.so.9.0.0 |
○ | setupDynamicPairlistPruning(gm[...] | pairlist_tuning.cpp:737 | libgromacs_mpi.so.9.0.0 |
○ | Nbnxm::init_nb_verlet(gmx::MDL[...] | nbnxm_setup.cpp:431 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:1859 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►9.78+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1455 | libgromacs_mpi.so.9.0.0 |
○ | setupDynamicPairlistPruning(gm[...] | pairlist_tuning.cpp:555 | libgromacs_mpi.so.9.0.0 |
○ | Nbnxm::init_nb_verlet(gmx::MDL[...] | nbnxm_setup.cpp:431 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:1859 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►5.24+ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1439 | libgromacs_mpi.so.9.0.0 |
○ | increaseNstlist(_IO_FILE*, t_c[...] | pairlist_tuning.cpp:311 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:607 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►4.25+ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1439 | libgromacs_mpi.so.9.0.0 |
○ | setupDynamicPairlistPruning(gm[...] | pairlist_tuning.cpp:555 | libgromacs_mpi.so.9.0.0 |
○ | Nbnxm::init_nb_verlet(gmx::MDL[...] | nbnxm_setup.cpp:431 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:1859 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►2.55+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1455 | libgromacs_mpi.so.9.0.0 |
○ | setupDynamicPairlistPruning(gm[...] | pairlist_tuning.cpp:757 | libgromacs_mpi.so.9.0.0 |
○ | Nbnxm::init_nb_verlet(gmx::MDL[...] | nbnxm_setup.cpp:431 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:1859 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►2.55+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1455 | libgromacs_mpi.so.9.0.0 |
○ | increaseNstlist(_IO_FILE*, t_c[...] | pairlist_tuning.cpp:284 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:607 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►1.77+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1455 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:573 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►1.06+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | verletBufferPressureError(gmx_[...] | calc_verletbuf.cpp:1537 | libgromacs_mpi.so.9.0.0 |
○ | printNbnxmPressureError(gmx::M[...] | pairlist_tuning.cpp:795 | libgromacs_mpi.so.9.0.0 |
○ | Nbnxm::init_nb_verlet(gmx::MDL[...] | nbnxm_setup.cpp:436 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:1859 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 |
Coverage (%) | Name | Source Location | Module |
---|---|---|---|
►54.89+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1455 | libgromacs_mpi.so.9.0.0 |
○ | increaseNstlist(_IO_FILE*, t_c[...] | pairlist_tuning.cpp:311 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:607 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►14.37+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1455 | libgromacs_mpi.so.9.0.0 |
○ | setupDynamicPairlistPruning(gm[...] | pairlist_tuning.cpp:737 | libgromacs_mpi.so.9.0.0 |
○ | Nbnxm::init_nb_verlet(gmx::MDL[...] | nbnxm_setup.cpp:431 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:1859 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►9.75+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1455 | libgromacs_mpi.so.9.0.0 |
○ | setupDynamicPairlistPruning(gm[...] | pairlist_tuning.cpp:555 | libgromacs_mpi.so.9.0.0 |
○ | Nbnxm::init_nb_verlet(gmx::MDL[...] | nbnxm_setup.cpp:431 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:1859 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►6.19+ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1439 | libgromacs_mpi.so.9.0.0 |
○ | increaseNstlist(_IO_FILE*, t_c[...] | pairlist_tuning.cpp:311 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:607 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►4.59+ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1439 | libgromacs_mpi.so.9.0.0 |
○ | setupDynamicPairlistPruning(gm[...] | pairlist_tuning.cpp:555 | libgromacs_mpi.so.9.0.0 |
○ | Nbnxm::init_nb_verlet(gmx::MDL[...] | nbnxm_setup.cpp:431 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:1859 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►1.98+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1455 | libgromacs_mpi.so.9.0.0 |
○ | increaseNstlist(_IO_FILE*, t_c[...] | pairlist_tuning.cpp:284 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:607 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►1.88+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1455 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:573 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►1.44+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1455 | libgromacs_mpi.so.9.0.0 |
○ | setupDynamicPairlistPruning(gm[...] | pairlist_tuning.cpp:757 | libgromacs_mpi.so.9.0.0 |
○ | Nbnxm::init_nb_verlet(gmx::MDL[...] | nbnxm_setup.cpp:431 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:1859 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►1.27+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | verletBufferPressureError(gmx_[...] | calc_verletbuf.cpp:1537 | libgromacs_mpi.so.9.0.0 |
○ | printNbnxmPressureError(gmx::M[...] | pairlist_tuning.cpp:795 | libgromacs_mpi.so.9.0.0 |
○ | Nbnxm::init_nb_verlet(gmx::MDL[...] | nbnxm_setup.cpp:436 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:1859 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►1.03+ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1439 | libgromacs_mpi.so.9.0.0 |
○ | increaseNstlist(_IO_FILE*, t_c[...] | pairlist_tuning.cpp:284 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:607 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 |
Coverage (%) | Name | Source Location | Module |
---|---|---|---|
►54.80+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1455 | libgromacs_mpi.so.9.0.0 |
○ | increaseNstlist(_IO_FILE*, t_c[...] | pairlist_tuning.cpp:311 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:607 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►14.97+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1455 | libgromacs_mpi.so.9.0.0 |
○ | setupDynamicPairlistPruning(gm[...] | pairlist_tuning.cpp:737 | libgromacs_mpi.so.9.0.0 |
○ | Nbnxm::init_nb_verlet(gmx::MDL[...] | nbnxm_setup.cpp:431 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:1859 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►8.99+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1455 | libgromacs_mpi.so.9.0.0 |
○ | setupDynamicPairlistPruning(gm[...] | pairlist_tuning.cpp:555 | libgromacs_mpi.so.9.0.0 |
○ | Nbnxm::init_nb_verlet(gmx::MDL[...] | nbnxm_setup.cpp:431 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:1859 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►6.19+ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1439 | libgromacs_mpi.so.9.0.0 |
○ | increaseNstlist(_IO_FILE*, t_c[...] | pairlist_tuning.cpp:311 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:607 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►4.27+ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1439 | libgromacs_mpi.so.9.0.0 |
○ | setupDynamicPairlistPruning(gm[...] | pairlist_tuning.cpp:555 | libgromacs_mpi.so.9.0.0 |
○ | Nbnxm::init_nb_verlet(gmx::MDL[...] | nbnxm_setup.cpp:431 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:1859 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►2.01+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1455 | libgromacs_mpi.so.9.0.0 |
○ | setupDynamicPairlistPruning(gm[...] | pairlist_tuning.cpp:757 | libgromacs_mpi.so.9.0.0 |
○ | Nbnxm::init_nb_verlet(gmx::MDL[...] | nbnxm_setup.cpp:431 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:1859 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►1.99+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1455 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:573 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►1.72+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1455 | libgromacs_mpi.so.9.0.0 |
○ | increaseNstlist(_IO_FILE*, t_c[...] | pairlist_tuning.cpp:284 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:607 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►1.22+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | verletBufferPressureError(gmx_[...] | calc_verletbuf.cpp:1537 | libgromacs_mpi.so.9.0.0 |
○ | printNbnxmPressureError(gmx::M[...] | pairlist_tuning.cpp:795 | libgromacs_mpi.so.9.0.0 |
○ | Nbnxm::init_nb_verlet(gmx::MDL[...] | nbnxm_setup.cpp:436 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:1859 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►1.05+ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1439 | libgromacs_mpi.so.9.0.0 |
○ | setupDynamicPairlistPruning(gm[...] | pairlist_tuning.cpp:737 | libgromacs_mpi.so.9.0.0 |
○ | Nbnxm::init_nb_verlet(gmx::MDL[...] | nbnxm_setup.cpp:431 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:1859 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 |
Coverage (%) | Name | Source Location | Module |
---|---|---|---|
►53.63+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1455 | libgromacs_mpi.so.9.0.0 |
○ | increaseNstlist(_IO_FILE*, t_c[...] | pairlist_tuning.cpp:311 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:607 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►15.00+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1455 | libgromacs_mpi.so.9.0.0 |
○ | setupDynamicPairlistPruning(gm[...] | pairlist_tuning.cpp:737 | libgromacs_mpi.so.9.0.0 |
○ | Nbnxm::init_nb_verlet(gmx::MDL[...] | nbnxm_setup.cpp:431 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:1859 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►9.53+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1455 | libgromacs_mpi.so.9.0.0 |
○ | setupDynamicPairlistPruning(gm[...] | pairlist_tuning.cpp:555 | libgromacs_mpi.so.9.0.0 |
○ | Nbnxm::init_nb_verlet(gmx::MDL[...] | nbnxm_setup.cpp:431 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:1859 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►6.12+ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1439 | libgromacs_mpi.so.9.0.0 |
○ | increaseNstlist(_IO_FILE*, t_c[...] | pairlist_tuning.cpp:311 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:607 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►5.01+ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1439 | libgromacs_mpi.so.9.0.0 |
○ | setupDynamicPairlistPruning(gm[...] | pairlist_tuning.cpp:555 | libgromacs_mpi.so.9.0.0 |
○ | Nbnxm::init_nb_verlet(gmx::MDL[...] | nbnxm_setup.cpp:431 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:1859 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►2.12+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1455 | libgromacs_mpi.so.9.0.0 |
○ | setupDynamicPairlistPruning(gm[...] | pairlist_tuning.cpp:757 | libgromacs_mpi.so.9.0.0 |
○ | Nbnxm::init_nb_verlet(gmx::MDL[...] | nbnxm_setup.cpp:431 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:1859 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►1.81+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1455 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:573 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►1.71+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1455 | libgromacs_mpi.so.9.0.0 |
○ | increaseNstlist(_IO_FILE*, t_c[...] | pairlist_tuning.cpp:284 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:607 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►1.22+ | pressureError(gmx::ArrayRef<Ve[...] | calc_verletbuf.cpp:1258 | libgromacs_mpi.so.9.0.0 |
○ | verletBufferPressureError(gmx_[...] | calc_verletbuf.cpp:1537 | libgromacs_mpi.so.9.0.0 |
○ | printNbnxmPressureError(gmx::M[...] | pairlist_tuning.cpp:795 | libgromacs_mpi.so.9.0.0 |
○ | Nbnxm::init_nb_verlet(gmx::MDL[...] | nbnxm_setup.cpp:436 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:1859 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►1.15+ | calcVerletBufferSize(gmx_mtop_[...] | calc_verletbuf.cpp:1439 | libgromacs_mpi.so.9.0.0 |
○ | increaseNstlist(_IO_FILE*, t_c[...] | pairlist_tuning.cpp:284 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:607 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 |
Path / |
Metric | Value |
---|---|
CQA speedup if no scalar integer | 1.10 |
CQA speedup if FP arith vectorized | 1.71 |
CQA speedup if fully vectorized | 7.47 |
CQA speedup if no inter-iteration dependency | NA |
CQA speedup if next bottleneck killed | NA |
Bottlenecks | micro-operation queue, |
Function | energyDrift(gmx::ArrayRef |
Source | std_abs.h:76-76,calc_verletbuf.cpp:606-613,calc_verletbuf.cpp:642-654,calc_verletbuf.cpp:663-663,calc_verletbuf.cpp:798-798,calc_verletbuf.cpp:806-827,calc_verletbuf.cpp:835-849,functions.h:321-321,calc_verletbuf.h:263-269,calc_verletbuf.h:284-291,stl_vector.h:1064-1064 |
Source loop unroll info | not unrolled or unrolled with no peel/tail loop |
Source loop unroll confidence level | max |
Unroll/vectorization loop type | NA |
Unroll factor | NA |
CQA cycles | 30.83 |
CQA cycles if no scalar integer | 28.00 |
CQA cycles if FP arith vectorized | 17.98 |
CQA cycles if fully vectorized | 4.13 |
Front-end cycles | 30.83 |
P0 cycles | 8.25 |
P1 cycles | 8.25 |
P2 cycles | 8.25 |
P3 cycles | 8.25 |
P4 cycles | 6.00 |
P5 cycles | 24.33 |
P6 cycles | 24.33 |
P7 cycles | 24.33 |
P8 cycles | 21.00 |
P9 cycles | 21.00 |
P10 cycles | 18.50 |
P11 cycles | 18.50 |
P12 cycles | 8.00 |
P13 cycles | 8.00 |
DIV/SQRT cycles | 28.00 |
Inter-iter dependencies cycles | NA |
FE+BE cycles (UFS) | NA |
Stall cycles (UFS) | NA |
Nb insns | 162.00 |
Nb uops | 185.00 |
Nb loads | 60.00 |
Nb stores | 10.00 |
Nb stack references | 20.00 |
FLOP/cycle | 2.14 |
Nb FLOP add-sub | 6.00 |
Nb FLOP mul | 40.00 |
Nb FLOP fma | 6.00 |
Nb FLOP div | 7.00 |
Nb FLOP rcp | 0.00 |
Nb FLOP sqrt | 1.00 |
Nb FLOP rsqrt | 0.00 |
Bytes/cycle | 11.48 |
Bytes prefetched | 0.00 |
Bytes loaded | 290.00 |
Bytes stored | 64.00 |
Stride 0 | NA |
Stride 1 | NA |
Stride n | NA |
Stride unknown | NA |
Stride indirect | NA |
Vectorization ratio all | 8.33 |
Vectorization ratio load | 7.32 |
Vectorization ratio store | 20.00 |
Vectorization ratio mul | 9.68 |
Vectorization ratio add_sub | 0.00 |
Vectorization ratio fma | 33.33 |
Vectorization ratio div_sqrt | 0.00 |
Vectorization ratio other | 9.76 |
Vector-efficiency ratio all | 8.65 |
Vector-efficiency ratio load | 8.84 |
Vector-efficiency ratio store | 10.00 |
Vector-efficiency ratio mul | 9.48 |
Vector-efficiency ratio add_sub | 8.04 |
Vector-efficiency ratio fma | 12.50 |
Vector-efficiency ratio div_sqrt | 7.03 |
Vector-efficiency ratio other | 8.54 |
Metric | Value |
---|---|
CQA speedup if no scalar integer | 1.10 |
CQA speedup if FP arith vectorized | 1.71 |
CQA speedup if fully vectorized | 7.47 |
CQA speedup if no inter-iteration dependency | NA |
CQA speedup if next bottleneck killed | NA |
Bottlenecks | micro-operation queue, |
Function | energyDrift(gmx::ArrayRef |
Source | std_abs.h:76-76,calc_verletbuf.cpp:606-613,calc_verletbuf.cpp:642-654,calc_verletbuf.cpp:663-663,calc_verletbuf.cpp:798-798,calc_verletbuf.cpp:806-827,calc_verletbuf.cpp:835-849,functions.h:321-321,calc_verletbuf.h:263-269,calc_verletbuf.h:284-291,stl_vector.h:1064-1064 |
Source loop unroll info | not unrolled or unrolled with no peel/tail loop |
Source loop unroll confidence level | max |
Unroll/vectorization loop type | NA |
Unroll factor | NA |
CQA cycles | 30.83 |
CQA cycles if no scalar integer | 28.00 |
CQA cycles if FP arith vectorized | 17.98 |
CQA cycles if fully vectorized | 4.13 |
Front-end cycles | 30.83 |
P0 cycles | 8.25 |
P1 cycles | 8.25 |
P2 cycles | 8.25 |
P3 cycles | 8.25 |
P4 cycles | 6.00 |
P5 cycles | 24.33 |
P6 cycles | 24.33 |
P7 cycles | 24.33 |
P8 cycles | 21.00 |
P9 cycles | 21.00 |
P10 cycles | 18.50 |
P11 cycles | 18.50 |
P12 cycles | 8.00 |
P13 cycles | 8.00 |
DIV/SQRT cycles | 28.00 |
Inter-iter dependencies cycles | NA |
FE+BE cycles (UFS) | NA |
Stall cycles (UFS) | NA |
Nb insns | 162.00 |
Nb uops | 185.00 |
Nb loads | 60.00 |
Nb stores | 10.00 |
Nb stack references | 20.00 |
FLOP/cycle | 2.14 |
Nb FLOP add-sub | 6.00 |
Nb FLOP mul | 40.00 |
Nb FLOP fma | 6.00 |
Nb FLOP div | 7.00 |
Nb FLOP rcp | 0.00 |
Nb FLOP sqrt | 1.00 |
Nb FLOP rsqrt | 0.00 |
Bytes/cycle | 11.48 |
Bytes prefetched | 0.00 |
Bytes loaded | 290.00 |
Bytes stored | 64.00 |
Stride 0 | NA |
Stride 1 | NA |
Stride n | NA |
Stride unknown | NA |
Stride indirect | NA |
Vectorization ratio all | 8.33 |
Vectorization ratio load | 7.32 |
Vectorization ratio store | 20.00 |
Vectorization ratio mul | 9.68 |
Vectorization ratio add_sub | 0.00 |
Vectorization ratio fma | 33.33 |
Vectorization ratio div_sqrt | 0.00 |
Vectorization ratio other | 9.76 |
Vector-efficiency ratio all | 8.65 |
Vector-efficiency ratio load | 8.84 |
Vector-efficiency ratio store | 10.00 |
Vector-efficiency ratio mul | 9.48 |
Vector-efficiency ratio add_sub | 8.04 |
Vector-efficiency ratio fma | 12.50 |
Vector-efficiency ratio div_sqrt | 7.03 |
Vector-efficiency ratio other | 8.54 |
Path / |
Function | energyDrift(gmx::ArrayRef |
Source file and lines | calc_verletbuf.cpp:606-849 |
Module | libgromacs_mpi.so.9.0.0 |
nb instructions | 162 |
nb uops | 185 |
loop length | 773 |
used x86 registers | 13 |
used mmx registers | 0 |
used xmm registers | 9 |
used ymm registers | 0 |
used zmm registers | 0 |
nb stack references | 20 |
ADD-SUB / MUL ratio | 0.19 |
micro-operation queue | 30.83 cycles |
front end | 30.83 cycles |
ALU0/BRU0 | ALU1 | ALU2 | ALU3 | BRU1 | AGU0 | AGU1 | AGU2 | FP0 | FP1 | FP2 | FP3 | FP4 | FP5 | |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
uops | 8.25 | 8.25 | 8.25 | 8.25 | 6.00 | 24.33 | 24.33 | 24.33 | 21.00 | 21.00 | 18.50 | 18.50 | 8.00 | 8.00 |
cycles | 8.25 | 8.25 | 8.25 | 8.25 | 6.00 | 24.33 | 24.33 | 24.33 | 21.00 | 21.00 | 18.50 | 18.50 | 8.00 | 8.00 |
Cycles executing div or sqrt instructions | 28.00 |
Front-end | 30.83 |
Dispatch | 24.33 |
DIV/SQRT | 28.00 |
Overall L1 | 30.83 |
all | 0% |
load | 0% |
store | 0% |
mul | NA (no mul vectorizable/vectorized instructions) |
add-sub | 0% |
fma | NA (no fma vectorizable/vectorized instructions) |
other | 0% |
all | 10% |
load | 7% |
store | 22% |
mul | 9% |
add-sub | 0% |
fma | 33% |
div/sqrt | 0% |
other | 18% |
all | 8% |
load | 7% |
store | 20% |
mul | 9% |
add-sub | 0% |
fma | 33% |
div/sqrt | 0% |
other | 9% |
all | 6% |
load | 9% |
store | 6% |
mul | NA (no mul vectorizable/vectorized instructions) |
add-sub | 12% |
fma | NA (no fma vectorizable/vectorized instructions) |
other | 6% |
all | 9% |
load | 8% |
store | 10% |
mul | 9% |
add-sub | 7% |
fma | 12% |
div/sqrt | 7% |
other | 10% |
all | 8% |
load | 8% |
store | 10% |
mul | 9% |
add-sub | 8% |
fma | 12% |
div/sqrt | 7% |
other | 8% |
Instruction | Nb FU | ALU0/BRU0 | ALU1 | ALU2 | ALU3 | BRU1 | AGU0 | AGU1 | AGU2 | FP0 | FP1 | FP2 | FP3 | FP4 | FP5 | Latency | Recip. throughput | Vectorization |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
VMOVSS %XMM3,-0x2c(%RBP) | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 1 | 1 | scal (6.3%) |
VMOVSD %XMM4,-0x48(%RBP) | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 1 | 1 | scal (12.5%) |
CALL fa66c0 <@plt_start@+0x3210> | 2 | 0.50 | 0 | 0 | 0 | 0.50 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | N/A |
VMOVSD -0x48(%RBP),%XMM4 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | scal (12.5%) |
VMOVSS -0x2c(%RBP),%XMM3 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | scal (6.3%) |
VMOVSS -0x3c(%RBP),%XMM2 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | scal (6.3%) |
MOV -0x68(%RBP),%R8 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 0.33 | N/A |
MOV -0x60(%RBP),%R9 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 0.33 | N/A |
VMOVSS -0x38(%RBP),%XMM7 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | scal (6.3%) |
VMOVSD -0x50(%RBP),%XMM5 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | scal (12.5%) |
VMOVSS -0x34(%RBP),%XMM1 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | scal (6.3%) |
VADDSS %XMM3,%XMM1,%XMM1 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
VCVTSS2SD %XMM1,%XMM1,%XMM1 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
VMULSD %XMM1,%XMM4,%XMM1 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | scal (12.5%) |
VCVTSD2SS %XMM1,%XMM1,%XMM1 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 3 | 0.50 | scal (12.5%) |
VADDSS %XMM2,%XMM0,%XMM0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
VMULSS %XMM0,%XMM0,%XMM0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
VCVTSS2SD %XMM0,%XMM0,%XMM0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
VMULSD -0x76bb31(%RIP),%XMM0,%XMM0 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | scal (12.5%) |
VMULSD -0x98(%RBP),%XMM0,%XMM0 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | scal (12.5%) |
VCVTSS2SD %XMM1,%XMM1,%XMM1 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
VDIVSD -0x90(%RBP),%XMM0,%XMM0 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 13 | 5 | scal (12.5%) |
VMULSD %XMM1,%XMM0,%XMM0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | scal (12.5%) |
VCVTSD2SS %XMM0,%XMM0,%XMM0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 3 | 0.50 | scal (12.5%) |
VANDPS -0x76d06b(%RIP){1to4},%XMM0,%XMM0 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0 | 1 | 0.50 | vect (25.0%) |
VCVTSS2SD %XMM0,%XMM0,%XMM0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
VADDSD %XMM0,%XMM5,%XMM5 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 3 | 0.50 | scal (12.5%) |
ADD $0x20,%R13 | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.25 | N/A |
CMP %R14,-0xa8(%RBP) | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.33 | scal (12.5%) |
JE ac8f80 <_ZL11energyDriftN3gmx8ArrayRefIK17VerletbufAtomtypeEEPK14gmx_ffparams_tfRK17pot_derivatives_tS9_S9_fffif+0xc0> | 1 | 0.50 | 0 | 0 | 0 | 0.50 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50-1 | N/A |
MOVSX 0xa(%R13),%EAX | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.33 | N/A |
VCVTSI2SS %EAX,%XMM8,%XMM2 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 3 | 1.25 | scal (6.3%) |
VMULSS -0x76cd9d(%RIP),%XMM2,%XMM0 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
MOVSX (%R13),%EAX | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.33 | N/A |
VCVTSI2SS %EAX,%XMM8,%XMM1 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 3 | 1.25 | scal (6.3%) |
VUCOMISS %XMM0,%XMM1 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0.50 | 0.50 | 6 | 1 | scal (6.3%) |
VMOVSS 0x10(%R13),%XMM3 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | scal (6.3%) |
VMOVSD %XMM5,-0x50(%RBP) | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 1 | 1 | scal (12.5%) |
JBE ac9500 <_ZL11energyDriftN3gmx8ArrayRefIK17VerletbufAtomtypeEEPK14gmx_ffparams_tfRK17pot_derivatives_tS9_S9_fffif+0x640> | 1 | 0.50 | 0 | 0 | 0 | 0.50 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50-1 | N/A |
VMULSS %XMM2,%XMM3,%XMM2 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
VMULSS %XMM1,%XMM3,%XMM3 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
VMOVSS -0x76d2fb(%RIP),%XMM6 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | scal (6.3%) |
VDIVSS %XMM3,%XMM6,%XMM4 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 11 | 3 | scal (6.3%) |
VDIVSS %XMM2,%XMM6,%XMM5 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 11 | 3 | scal (6.3%) |
VADDSS %XMM4,%XMM5,%XMM4 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
VMULSS %XMM4,%XMM2,%XMM2 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
VDIVSS %XMM2,%XMM6,%XMM2 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 11 | 3 | scal (6.3%) |
VMULSS %XMM7,%XMM2,%XMM5 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
VMULSS %XMM5,%XMM3,%XMM3 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
MOVSX 0xc(%R13),%EAX | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.33 | N/A |
VCVTSI2SS %EAX,%XMM8,%XMM5 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 3 | 1.25 | scal (6.3%) |
VMULSS 0x18(%R13),%XMM5,%XMM5 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
VMULSS %XMM2,%XMM5,%XMM2 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
VMULSS %XMM2,%XMM2,%XMM2 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
VDIVSS %XMM2,%XMM3,%XMM3 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 11 | 3 | scal (6.3%) |
VMOVSS -0x76d02a(%RIP),%XMM5 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | scal (6.3%) |
VMINSS %XMM3,%XMM5,%XMM3 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 2 | 0.50 | scal (6.3%) |
VMULSS %XMM3,%XMM2,%XMM2 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
VMOVAPS %XMM6,%XMM5 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.17 | vect (25.0%) |
VFMADD231SS -0x76d2af(%RIP),%XMM3,%XMM5 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 4 | 0.50 | scal (6.3%) |
VMULSS %XMM3,%XMM3,%XMM3 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
VFMADD132SS -0x76ccc8(%RIP),%XMM5,%XMM3 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 4 | 0.50 | scal (6.3%) |
VDIVSS %XMM3,%XMM2,%XMM2 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 11 | 3 | scal (6.3%) |
VDIVSS %XMM4,%XMM7,%XMM3 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 11 | 3 | scal (6.3%) |
JMP ac950c <_ZL11energyDriftN3gmx8ArrayRefIK17VerletbufAtomtypeEEPK14gmx_ffparams_tfRK17pot_derivatives_tS9_S9_fffif+0x64c> | 1 | 0.50 | 0 | 0 | 0 | 0.50 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | N/A |
VMULSS %XMM1,%XMM3,%XMM2 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
VMULSS %XMM7,%XMM2,%XMM3 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
VXORPS %XMM2,%XMM2,%XMM2 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.17 | vect (25.0%) |
VMOVSS %XMM2,-0x48(%RBP) | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 1 | 1 | scal (6.3%) |
XOR %ESI,%ESI | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.25 | scal (6.3%) |
VUCOMISS %XMM0,%XMM1 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0.50 | 0.50 | 6 | 1 | scal (6.3%) |
SETA %SIL | 1 | 0.50 | 0 | 0 | 0.50 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | N/A |
MOVSXD 0x4(%R15),%RAX | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.33 | N/A |
MOVSXD (%R12),%RCX | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.33 | N/A |
IMUL %RAX,%RCX | 1 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 1 | N/A |
MOVSXD 0x4(%R13),%RAX | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.33 | N/A |
ADD %RCX,%RAX | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.25 | N/A |
MOV 0x20(%R12),%RCX | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 0.33 | N/A |
LEA (%RAX,%RAX,2),%RAX | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.25 | N/A |
SAL $0x4,%RAX | 1 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | N/A |
VBROADCASTSS 0x4(%RCX,%RAX,1),%XMM0 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 4 | 0.50 | scal (6.3%) |
VBROADCASTSS (%RCX,%RAX,1),%XMM1 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 4 | 0.50 | scal (6.3%) |
VMULPS (%R8),%XMM0,%XMM0 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | vect (25.0%) |
VFMADD231PS (%R9),%XMM1,%XMM0 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 4 | 0.50 | vect (25.0%) |
VADDSS -0x84(%RBP),%XMM2,%XMM1 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
VMOVAPS %XMM0,-0xc0(%RBP) | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 4 | 1 | vect (25.0%) |
VADDSS %XMM3,%XMM1,%XMM0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
VMOVSS %XMM0,-0x2c(%RBP) | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 1 | 1 | scal (6.3%) |
MOVSX 0xa(%R15),%EAX | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.33 | N/A |
VCVTSI2SS %EAX,%XMM8,%XMM3 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 3 | 1.25 | scal (6.3%) |
VMOVSS -0x76cec0(%RIP),%XMM1 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | scal (6.3%) |
VMULSS %XMM1,%XMM3,%XMM3 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
MOVSX (%R15),%EAX | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.33 | N/A |
VCVTSI2SS %EAX,%XMM8,%XMM1 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 3 | 1.25 | scal (6.3%) |
XOR %EDI,%EDI | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.25 | scal (6.3%) |
VUCOMISS %XMM3,%XMM1 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0.50 | 0.50 | 6 | 1 | scal (6.3%) |
SETA %DIL | 1 | 0.50 | 0 | 0 | 0.50 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | N/A |
VMOVSS -0x30(%RBP),%XMM1 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | scal (6.3%) |
VMOVSS -0x58(%RBP),%XMM3 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | scal (6.3%) |
LEA -0xc0(%RBP),%RDX | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.25 | N/A |
CALL ac9c70 <_ZL19energyDriftAtomPairbbffffPK17pot_derivatives_t> | 2 | 0.50 | 0 | 0 | 0 | 0.50 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | N/A |
MOVSX 0x8(%R15),%EAX | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.33 | N/A |
VCVTSI2SS %EAX,%XMM8,%XMM1 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 3 | 1.25 | scal (6.3%) |
VMULSS 0x14(%R15),%XMM1,%XMM1 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
MOVSX 0x8(%R13),%EAX | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.33 | N/A |
VCVTSI2SS %EAX,%XMM8,%XMM2 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 3 | 1.25 | scal (6.3%) |
VMULSS 0x14(%R13),%XMM2,%XMM2 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
VMOVSD (%RBX),%XMM3 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | scal (12.5%) |
VBROADCASTSS %XMM1,%XMM4 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 1 | 0.33 | scal (6.3%) |
VMULPS %XMM4,%XMM3,%XMM3 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | vect (25.0%) |
VBROADCASTSS %XMM2,%XMM4 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 1 | 0.33 | scal (6.3%) |
VMULPS %XMM3,%XMM4,%XMM3 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | vect (25.0%) |
VMOVLPS %XMM3,-0x80(%RBP) | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 1 | 1 | vect (12.5%) |
VMULSS 0x8(%RBX),%XMM1,%XMM1 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
VMULSS %XMM1,%XMM2,%XMM1 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
VMOVSS %XMM1,-0x78(%RBP) | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 1 | 1 | scal (6.3%) |
MOVL $0,-0x74(%RBP) | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 4 | 0.50 | scal (6.3%) |
MOVSX 0xa(%R15),%EAX | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.33 | N/A |
VCVTSI2SS %EAX,%XMM8,%XMM1 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 3 | 1.25 | scal (6.3%) |
VMOVSS -0x76cf4b(%RIP),%XMM3 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | scal (6.3%) |
VMULSS %XMM3,%XMM1,%XMM1 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
MOVSX (%R15),%EAX | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.33 | N/A |
VCVTSI2SS %EAX,%XMM8,%XMM2 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 3 | 1.25 | scal (6.3%) |
XOR %EDI,%EDI | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.25 | scal (6.3%) |
VUCOMISS %XMM1,%XMM2 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0.50 | 0.50 | 6 | 1 | scal (6.3%) |
SETA %DIL | 1 | 0.50 | 0 | 0 | 0.50 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | N/A |
VMOVSS %XMM0,-0x34(%RBP) | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 1 | 1 | scal (6.3%) |
MOVSX 0xa(%R13),%EAX | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.33 | N/A |
VCVTSI2SS %EAX,%XMM8,%XMM0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 3 | 1.25 | scal (6.3%) |
VMULSS %XMM3,%XMM0,%XMM0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
MOVSX (%R13),%EAX | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.33 | N/A |
VCVTSI2SS %EAX,%XMM8,%XMM1 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 3 | 1.25 | scal (6.3%) |
XOR %ESI,%ESI | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.25 | scal (6.3%) |
VUCOMISS %XMM0,%XMM1 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0.50 | 0.50 | 6 | 1 | scal (6.3%) |
SETA %SIL | 1 | 0.50 | 0 | 0 | 0.50 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | N/A |
VMOVSS -0x2c(%RBP),%XMM0 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | scal (6.3%) |
VMOVSS -0x30(%RBP),%XMM1 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | scal (6.3%) |
VMOVSS -0x48(%RBP),%XMM2 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | scal (6.3%) |
VMOVSS -0x54(%RBP),%XMM3 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | scal (6.3%) |
LEA -0x80(%RBP),%RDX | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.25 | N/A |
CALL ac9c70 <_ZL19energyDriftAtomPairbbffffPK17pot_derivatives_t> | 2 | 0.50 | 0 | 0 | 0 | 0.50 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | N/A |
VMOVAPD %XMM0,%XMM3 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.17 | vect (25.0%) |
MOV -0xa0(%RBP),%RAX | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 0.33 | N/A |
MOV (%RAX),%EAX | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 0.33 | N/A |
VCVTSI2SD %EAX,%XMM8,%XMM0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 3 | 1.25 | scal (6.3%) |
SUB $0x1,%R14 | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.25 | scal (12.5%) |
JAE ac96a0 <_ZL11energyDriftN3gmx8ArrayRefIK17VerletbufAtomtypeEEPK14gmx_ffparams_tfRK17pot_derivatives_tS9_S9_fffif+0x7e0> | 1 | 0.50 | 0 | 0 | 0 | 0.50 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50-1 | N/A |
DEC %EAX | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.25 | N/A |
VCVTSI2SD %EAX,%XMM8,%XMM1 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 3 | 1.25 | scal (6.3%) |
VMULSD %XMM1,%XMM0,%XMM0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | scal (12.5%) |
VMULSD -0x76c528(%RIP),%XMM0,%XMM4 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | scal (12.5%) |
VMOVSS -0x2c(%RBP),%XMM0 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | scal (6.3%) |
VUCOMISS -0x76d329(%RIP),%XMM0 | 2 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0.50 | 0.50 | 0.50 | 0.50 | 6 | 1 | scal (6.3%) |
JB ac93b0 <_ZL11energyDriftN3gmx8ArrayRefIK17VerletbufAtomtypeEEPK14gmx_ffparams_tfRK17pot_derivatives_tS9_S9_fffif+0x4f0> | 1 | 0.50 | 0 | 0 | 0 | 0.50 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50-1 | N/A |
JMP ac96bd <_ZL11energyDriftN3gmx8ArrayRefIK17VerletbufAtomtypeEEPK14gmx_ffparams_tfRK17pot_derivatives_tS9_S9_fffif+0x7fd> | 1 | 0.50 | 0 | 0 | 0 | 0.50 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | N/A |
VCVTSI2SDL 0x1c(%R13),%XMM8,%XMM1 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
VMULSD %XMM1,%XMM0,%XMM4 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | scal (12.5%) |
VMOVSS -0x2c(%RBP),%XMM0 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | scal (6.3%) |
VUCOMISS -0x76d34b(%RIP),%XMM0 | 2 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0.50 | 0.50 | 0.50 | 0.50 | 6 | 1 | scal (6.3%) |
JB ac93b0 <_ZL11energyDriftN3gmx8ArrayRefIK17VerletbufAtomtypeEEPK14gmx_ffparams_tfRK17pot_derivatives_tS9_S9_fffif+0x4f0> | 1 | 0.50 | 0 | 0 | 0 | 0.50 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50-1 | N/A |
VSQRTSS %XMM0,%XMM0,%XMM0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 15 | 5 | scal (6.3%) |
JMP ac93c9 <_ZL11energyDriftN3gmx8ArrayRefIK17VerletbufAtomtypeEEPK14gmx_ffparams_tfRK17pot_derivatives_tS9_S9_fffif+0x509> | 1 | 0.50 | 0 | 0 | 0 | 0.50 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | N/A |
Function | energyDrift(gmx::ArrayRef |
Source file and lines | calc_verletbuf.cpp:606-849 |
Module | libgromacs_mpi.so.9.0.0 |
nb instructions | 162 |
nb uops | 185 |
loop length | 773 |
used x86 registers | 13 |
used mmx registers | 0 |
used xmm registers | 9 |
used ymm registers | 0 |
used zmm registers | 0 |
nb stack references | 20 |
ADD-SUB / MUL ratio | 0.19 |
micro-operation queue | 30.83 cycles |
front end | 30.83 cycles |
ALU0/BRU0 | ALU1 | ALU2 | ALU3 | BRU1 | AGU0 | AGU1 | AGU2 | FP0 | FP1 | FP2 | FP3 | FP4 | FP5 | |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
uops | 8.25 | 8.25 | 8.25 | 8.25 | 6.00 | 24.33 | 24.33 | 24.33 | 21.00 | 21.00 | 18.50 | 18.50 | 8.00 | 8.00 |
cycles | 8.25 | 8.25 | 8.25 | 8.25 | 6.00 | 24.33 | 24.33 | 24.33 | 21.00 | 21.00 | 18.50 | 18.50 | 8.00 | 8.00 |
Cycles executing div or sqrt instructions | 28.00 |
Front-end | 30.83 |
Dispatch | 24.33 |
DIV/SQRT | 28.00 |
Overall L1 | 30.83 |
all | 0% |
load | 0% |
store | 0% |
mul | NA (no mul vectorizable/vectorized instructions) |
add-sub | 0% |
fma | NA (no fma vectorizable/vectorized instructions) |
other | 0% |
all | 10% |
load | 7% |
store | 22% |
mul | 9% |
add-sub | 0% |
fma | 33% |
div/sqrt | 0% |
other | 18% |
all | 8% |
load | 7% |
store | 20% |
mul | 9% |
add-sub | 0% |
fma | 33% |
div/sqrt | 0% |
other | 9% |
all | 6% |
load | 9% |
store | 6% |
mul | NA (no mul vectorizable/vectorized instructions) |
add-sub | 12% |
fma | NA (no fma vectorizable/vectorized instructions) |
other | 6% |
all | 9% |
load | 8% |
store | 10% |
mul | 9% |
add-sub | 7% |
fma | 12% |
div/sqrt | 7% |
other | 10% |
all | 8% |
load | 8% |
store | 10% |
mul | 9% |
add-sub | 8% |
fma | 12% |
div/sqrt | 7% |
other | 8% |
Instruction | Nb FU | ALU0/BRU0 | ALU1 | ALU2 | ALU3 | BRU1 | AGU0 | AGU1 | AGU2 | FP0 | FP1 | FP2 | FP3 | FP4 | FP5 | Latency | Recip. throughput | Vectorization |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
VMOVSS %XMM3,-0x2c(%RBP) | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 1 | 1 | scal (6.3%) |
VMOVSD %XMM4,-0x48(%RBP) | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 1 | 1 | scal (12.5%) |
CALL fa66c0 <@plt_start@+0x3210> | 2 | 0.50 | 0 | 0 | 0 | 0.50 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | N/A |
VMOVSD -0x48(%RBP),%XMM4 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | scal (12.5%) |
VMOVSS -0x2c(%RBP),%XMM3 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | scal (6.3%) |
VMOVSS -0x3c(%RBP),%XMM2 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | scal (6.3%) |
MOV -0x68(%RBP),%R8 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 0.33 | N/A |
MOV -0x60(%RBP),%R9 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 0.33 | N/A |
VMOVSS -0x38(%RBP),%XMM7 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | scal (6.3%) |
VMOVSD -0x50(%RBP),%XMM5 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | scal (12.5%) |
VMOVSS -0x34(%RBP),%XMM1 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | scal (6.3%) |
VADDSS %XMM3,%XMM1,%XMM1 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
VCVTSS2SD %XMM1,%XMM1,%XMM1 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
VMULSD %XMM1,%XMM4,%XMM1 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | scal (12.5%) |
VCVTSD2SS %XMM1,%XMM1,%XMM1 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 3 | 0.50 | scal (12.5%) |
VADDSS %XMM2,%XMM0,%XMM0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
VMULSS %XMM0,%XMM0,%XMM0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
VCVTSS2SD %XMM0,%XMM0,%XMM0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
VMULSD -0x76bb31(%RIP),%XMM0,%XMM0 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | scal (12.5%) |
VMULSD -0x98(%RBP),%XMM0,%XMM0 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | scal (12.5%) |
VCVTSS2SD %XMM1,%XMM1,%XMM1 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
VDIVSD -0x90(%RBP),%XMM0,%XMM0 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 13 | 5 | scal (12.5%) |
VMULSD %XMM1,%XMM0,%XMM0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | scal (12.5%) |
VCVTSD2SS %XMM0,%XMM0,%XMM0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 3 | 0.50 | scal (12.5%) |
VANDPS -0x76d06b(%RIP){1to4},%XMM0,%XMM0 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0 | 1 | 0.50 | vect (25.0%) |
VCVTSS2SD %XMM0,%XMM0,%XMM0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
VADDSD %XMM0,%XMM5,%XMM5 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 3 | 0.50 | scal (12.5%) |
ADD $0x20,%R13 | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.25 | N/A |
CMP %R14,-0xa8(%RBP) | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.33 | scal (12.5%) |
JE ac8f80 <_ZL11energyDriftN3gmx8ArrayRefIK17VerletbufAtomtypeEEPK14gmx_ffparams_tfRK17pot_derivatives_tS9_S9_fffif+0xc0> | 1 | 0.50 | 0 | 0 | 0 | 0.50 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50-1 | N/A |
MOVSX 0xa(%R13),%EAX | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.33 | N/A |
VCVTSI2SS %EAX,%XMM8,%XMM2 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 3 | 1.25 | scal (6.3%) |
VMULSS -0x76cd9d(%RIP),%XMM2,%XMM0 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
MOVSX (%R13),%EAX | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.33 | N/A |
VCVTSI2SS %EAX,%XMM8,%XMM1 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 3 | 1.25 | scal (6.3%) |
VUCOMISS %XMM0,%XMM1 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0.50 | 0.50 | 6 | 1 | scal (6.3%) |
VMOVSS 0x10(%R13),%XMM3 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | scal (6.3%) |
VMOVSD %XMM5,-0x50(%RBP) | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 1 | 1 | scal (12.5%) |
JBE ac9500 <_ZL11energyDriftN3gmx8ArrayRefIK17VerletbufAtomtypeEEPK14gmx_ffparams_tfRK17pot_derivatives_tS9_S9_fffif+0x640> | 1 | 0.50 | 0 | 0 | 0 | 0.50 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50-1 | N/A |
VMULSS %XMM2,%XMM3,%XMM2 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
VMULSS %XMM1,%XMM3,%XMM3 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
VMOVSS -0x76d2fb(%RIP),%XMM6 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | scal (6.3%) |
VDIVSS %XMM3,%XMM6,%XMM4 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 11 | 3 | scal (6.3%) |
VDIVSS %XMM2,%XMM6,%XMM5 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 11 | 3 | scal (6.3%) |
VADDSS %XMM4,%XMM5,%XMM4 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
VMULSS %XMM4,%XMM2,%XMM2 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
VDIVSS %XMM2,%XMM6,%XMM2 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 11 | 3 | scal (6.3%) |
VMULSS %XMM7,%XMM2,%XMM5 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
VMULSS %XMM5,%XMM3,%XMM3 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
MOVSX 0xc(%R13),%EAX | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.33 | N/A |
VCVTSI2SS %EAX,%XMM8,%XMM5 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 3 | 1.25 | scal (6.3%) |
VMULSS 0x18(%R13),%XMM5,%XMM5 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
VMULSS %XMM2,%XMM5,%XMM2 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
VMULSS %XMM2,%XMM2,%XMM2 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
VDIVSS %XMM2,%XMM3,%XMM3 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 11 | 3 | scal (6.3%) |
VMOVSS -0x76d02a(%RIP),%XMM5 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | scal (6.3%) |
VMINSS %XMM3,%XMM5,%XMM3 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 2 | 0.50 | scal (6.3%) |
VMULSS %XMM3,%XMM2,%XMM2 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
VMOVAPS %XMM6,%XMM5 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.17 | vect (25.0%) |
VFMADD231SS -0x76d2af(%RIP),%XMM3,%XMM5 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 4 | 0.50 | scal (6.3%) |
VMULSS %XMM3,%XMM3,%XMM3 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
VFMADD132SS -0x76ccc8(%RIP),%XMM5,%XMM3 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 4 | 0.50 | scal (6.3%) |
VDIVSS %XMM3,%XMM2,%XMM2 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 11 | 3 | scal (6.3%) |
VDIVSS %XMM4,%XMM7,%XMM3 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 11 | 3 | scal (6.3%) |
JMP ac950c <_ZL11energyDriftN3gmx8ArrayRefIK17VerletbufAtomtypeEEPK14gmx_ffparams_tfRK17pot_derivatives_tS9_S9_fffif+0x64c> | 1 | 0.50 | 0 | 0 | 0 | 0.50 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | N/A |
VMULSS %XMM1,%XMM3,%XMM2 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
VMULSS %XMM7,%XMM2,%XMM3 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
VXORPS %XMM2,%XMM2,%XMM2 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.17 | vect (25.0%) |
VMOVSS %XMM2,-0x48(%RBP) | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 1 | 1 | scal (6.3%) |
XOR %ESI,%ESI | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.25 | scal (6.3%) |
VUCOMISS %XMM0,%XMM1 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0.50 | 0.50 | 6 | 1 | scal (6.3%) |
SETA %SIL | 1 | 0.50 | 0 | 0 | 0.50 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | N/A |
MOVSXD 0x4(%R15),%RAX | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.33 | N/A |
MOVSXD (%R12),%RCX | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.33 | N/A |
IMUL %RAX,%RCX | 1 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 1 | N/A |
MOVSXD 0x4(%R13),%RAX | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.33 | N/A |
ADD %RCX,%RAX | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.25 | N/A |
MOV 0x20(%R12),%RCX | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 0.33 | N/A |
LEA (%RAX,%RAX,2),%RAX | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.25 | N/A |
SAL $0x4,%RAX | 1 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | N/A |
VBROADCASTSS 0x4(%RCX,%RAX,1),%XMM0 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 4 | 0.50 | scal (6.3%) |
VBROADCASTSS (%RCX,%RAX,1),%XMM1 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 4 | 0.50 | scal (6.3%) |
VMULPS (%R8),%XMM0,%XMM0 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | vect (25.0%) |
VFMADD231PS (%R9),%XMM1,%XMM0 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 4 | 0.50 | vect (25.0%) |
VADDSS -0x84(%RBP),%XMM2,%XMM1 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
VMOVAPS %XMM0,-0xc0(%RBP) | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 4 | 1 | vect (25.0%) |
VADDSS %XMM3,%XMM1,%XMM0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
VMOVSS %XMM0,-0x2c(%RBP) | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 1 | 1 | scal (6.3%) |
MOVSX 0xa(%R15),%EAX | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.33 | N/A |
VCVTSI2SS %EAX,%XMM8,%XMM3 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 3 | 1.25 | scal (6.3%) |
VMOVSS -0x76cec0(%RIP),%XMM1 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | scal (6.3%) |
VMULSS %XMM1,%XMM3,%XMM3 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
MOVSX (%R15),%EAX | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.33 | N/A |
VCVTSI2SS %EAX,%XMM8,%XMM1 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 3 | 1.25 | scal (6.3%) |
XOR %EDI,%EDI | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.25 | scal (6.3%) |
VUCOMISS %XMM3,%XMM1 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0.50 | 0.50 | 6 | 1 | scal (6.3%) |
SETA %DIL | 1 | 0.50 | 0 | 0 | 0.50 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | N/A |
VMOVSS -0x30(%RBP),%XMM1 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | scal (6.3%) |
VMOVSS -0x58(%RBP),%XMM3 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | scal (6.3%) |
LEA -0xc0(%RBP),%RDX | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.25 | N/A |
CALL ac9c70 <_ZL19energyDriftAtomPairbbffffPK17pot_derivatives_t> | 2 | 0.50 | 0 | 0 | 0 | 0.50 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | N/A |
MOVSX 0x8(%R15),%EAX | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.33 | N/A |
VCVTSI2SS %EAX,%XMM8,%XMM1 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 3 | 1.25 | scal (6.3%) |
VMULSS 0x14(%R15),%XMM1,%XMM1 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
MOVSX 0x8(%R13),%EAX | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.33 | N/A |
VCVTSI2SS %EAX,%XMM8,%XMM2 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 3 | 1.25 | scal (6.3%) |
VMULSS 0x14(%R13),%XMM2,%XMM2 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
VMOVSD (%RBX),%XMM3 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | scal (12.5%) |
VBROADCASTSS %XMM1,%XMM4 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 1 | 0.33 | scal (6.3%) |
VMULPS %XMM4,%XMM3,%XMM3 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | vect (25.0%) |
VBROADCASTSS %XMM2,%XMM4 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 1 | 0.33 | scal (6.3%) |
VMULPS %XMM3,%XMM4,%XMM3 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | vect (25.0%) |
VMOVLPS %XMM3,-0x80(%RBP) | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 1 | 1 | vect (12.5%) |
VMULSS 0x8(%RBX),%XMM1,%XMM1 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
VMULSS %XMM1,%XMM2,%XMM1 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
VMOVSS %XMM1,-0x78(%RBP) | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 1 | 1 | scal (6.3%) |
MOVL $0,-0x74(%RBP) | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 4 | 0.50 | scal (6.3%) |
MOVSX 0xa(%R15),%EAX | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.33 | N/A |
VCVTSI2SS %EAX,%XMM8,%XMM1 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 3 | 1.25 | scal (6.3%) |
VMOVSS -0x76cf4b(%RIP),%XMM3 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | scal (6.3%) |
VMULSS %XMM3,%XMM1,%XMM1 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
MOVSX (%R15),%EAX | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.33 | N/A |
VCVTSI2SS %EAX,%XMM8,%XMM2 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 3 | 1.25 | scal (6.3%) |
XOR %EDI,%EDI | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.25 | scal (6.3%) |
VUCOMISS %XMM1,%XMM2 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0.50 | 0.50 | 6 | 1 | scal (6.3%) |
SETA %DIL | 1 | 0.50 | 0 | 0 | 0.50 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | N/A |
VMOVSS %XMM0,-0x34(%RBP) | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 1 | 1 | scal (6.3%) |
MOVSX 0xa(%R13),%EAX | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.33 | N/A |
VCVTSI2SS %EAX,%XMM8,%XMM0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 3 | 1.25 | scal (6.3%) |
VMULSS %XMM3,%XMM0,%XMM0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
MOVSX (%R13),%EAX | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.33 | N/A |
VCVTSI2SS %EAX,%XMM8,%XMM1 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 3 | 1.25 | scal (6.3%) |
XOR %ESI,%ESI | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.25 | scal (6.3%) |
VUCOMISS %XMM0,%XMM1 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0.50 | 0.50 | 6 | 1 | scal (6.3%) |
SETA %SIL | 1 | 0.50 | 0 | 0 | 0.50 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | N/A |
VMOVSS -0x2c(%RBP),%XMM0 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | scal (6.3%) |
VMOVSS -0x30(%RBP),%XMM1 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | scal (6.3%) |
VMOVSS -0x48(%RBP),%XMM2 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | scal (6.3%) |
VMOVSS -0x54(%RBP),%XMM3 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | scal (6.3%) |
LEA -0x80(%RBP),%RDX | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.25 | N/A |
CALL ac9c70 <_ZL19energyDriftAtomPairbbffffPK17pot_derivatives_t> | 2 | 0.50 | 0 | 0 | 0 | 0.50 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | N/A |
VMOVAPD %XMM0,%XMM3 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.17 | vect (25.0%) |
MOV -0xa0(%RBP),%RAX | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 0.33 | N/A |
MOV (%RAX),%EAX | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 0.33 | N/A |
VCVTSI2SD %EAX,%XMM8,%XMM0 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 3 | 1.25 | scal (6.3%) |
SUB $0x1,%R14 | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.25 | scal (12.5%) |
JAE ac96a0 <_ZL11energyDriftN3gmx8ArrayRefIK17VerletbufAtomtypeEEPK14gmx_ffparams_tfRK17pot_derivatives_tS9_S9_fffif+0x7e0> | 1 | 0.50 | 0 | 0 | 0 | 0.50 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50-1 | N/A |
DEC %EAX | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.25 | N/A |
VCVTSI2SD %EAX,%XMM8,%XMM1 | 2 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 3 | 1.25 | scal (6.3%) |
VMULSD %XMM1,%XMM0,%XMM0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | scal (12.5%) |
VMULSD -0x76c528(%RIP),%XMM0,%XMM4 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | scal (12.5%) |
VMOVSS -0x2c(%RBP),%XMM0 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | scal (6.3%) |
VUCOMISS -0x76d329(%RIP),%XMM0 | 2 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0.50 | 0.50 | 0.50 | 0.50 | 6 | 1 | scal (6.3%) |
JB ac93b0 <_ZL11energyDriftN3gmx8ArrayRefIK17VerletbufAtomtypeEEPK14gmx_ffparams_tfRK17pot_derivatives_tS9_S9_fffif+0x4f0> | 1 | 0.50 | 0 | 0 | 0 | 0.50 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50-1 | N/A |
JMP ac96bd <_ZL11energyDriftN3gmx8ArrayRefIK17VerletbufAtomtypeEEPK14gmx_ffparams_tfRK17pot_derivatives_tS9_S9_fffif+0x7fd> | 1 | 0.50 | 0 | 0 | 0 | 0.50 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | N/A |
VCVTSI2SDL 0x1c(%R13),%XMM8,%XMM1 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
VMULSD %XMM1,%XMM0,%XMM4 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 3 | 0.50 | scal (12.5%) |
VMOVSS -0x2c(%RBP),%XMM0 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | scal (6.3%) |
VUCOMISS -0x76d34b(%RIP),%XMM0 | 2 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0.50 | 0.50 | 0.50 | 0.50 | 6 | 1 | scal (6.3%) |
JB ac93b0 <_ZL11energyDriftN3gmx8ArrayRefIK17VerletbufAtomtypeEEPK14gmx_ffparams_tfRK17pot_derivatives_tS9_S9_fffif+0x4f0> | 1 | 0.50 | 0 | 0 | 0 | 0.50 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50-1 | N/A |
VSQRTSS %XMM0,%XMM0,%XMM0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 15 | 5 | scal (6.3%) |
JMP ac93c9 <_ZL11energyDriftN3gmx8ArrayRefIK17VerletbufAtomtypeEEPK14gmx_ffparams_tfRK17pot_derivatives_tS9_S9_fffif+0x509> | 1 | 0.50 | 0 | 0 | 0 | 0.50 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | N/A |
Run 1x1 | Number processes: 1Number processes per node: 1OMP_NUM_THREADS: 1 |
---|---|
Run 2x1 | Number processes: 2Number processes per node: 2OMP_NUM_THREADS: 1 |
Run 4x1 | Number processes: 4Number processes per node: 4OMP_NUM_THREADS: 1 |
Run 8x1 | Number processes: 8Number processes per node: 8OMP_NUM_THREADS: 1 |
Run 16x1 | Number processes: 16Number processes per node: 16OMP_NUM_THREADS: 1 |
Run 32x1 | Number processes: 32Number processes per node: 32OMP_NUM_THREADS: 1 |
Run 64x1 | Number processes: 64Number processes per node: 64OMP_NUM_THREADS: 1 |
Run 128x1 | Number processes: 128Number processes per node: 128OMP_NUM_THREADS: 1 |
Run 192x1 | Number processes: 192Number nodes: 1Number processes per node: 192Run Command: <executable> mdrun -s ion_channel.tpr -nsteps 10000 -pin on -deffnm aoccMPI Command: mpirun -genv I_MPI_FABRICS=shm -n <number_processes>Dataset: Run Directory: .OMP_NUM_THREADS: 1 |
(1x1) Efficiency | (1x1) Potential Speed-Up (%) | (2x1) Efficiency | (2x1) Potential Speed-Up (%) | (4x1) Efficiency | (4x1) Potential Speed-Up (%) | (8x1) Efficiency | (8x1) Potential Speed-Up (%) | (16x1) Efficiency | (16x1) Potential Speed-Up (%) | (32x1) Efficiency | (32x1) Potential Speed-Up (%) | (64x1) Efficiency | (64x1) Potential Speed-Up (%) | (128x1) Efficiency | (128x1) Potential Speed-Up (%) | (192x1) Efficiency | (192x1) Potential Speed-Up (%) |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
1 | 0 | 0.49 | 0.03 | 0.25 | 0.08 | 0.12 | 0.16 | 0.06 | 0.33 | 0.04 | 0.41 | 0.02 | 0.57 | 0.01 | 1.36 | 0.01 | 1.74 |
Run | Number of threads | Efficiency (ideal is 1) | Speedup | Ideal Speedup | Time (s) | Coverage (%) |
---|---|---|---|---|---|---|
1x1 | 1 | 1 | 1 | 1 | 0.26499998569489 | 0.031789653003216 |
2x1 | 2 | 0.49 | 0.97 | 2 | 0.30499997735023 | 0.06011875346303 |
4x1 | 4 | 0.25 | 0.99 | 4 | 0.3350000679493 | 0.10693857818842 |
8x1 | 8 | 0.12 | 0.97 | 8 | 0.32499998807907 | 0.17659085988998 |
16x1 | 16 | 0.06 | 0.93 | 16 | 0.38000005483627 | 0.34576025605202 |
32x1 | 32 | 0.04 | 1.2 | 32 | 0.33000001311302 | 0.42948105931282 |
64x1 | 64 | 0.02 | 1.16 | 64 | 0.35999995470047 | 0.57634484767914 |
128x1 | 128 | 0.01 | 1.14 | 128 | 0.34499990940094 | 1.3720963001251 |
192x1 | 192 | 0.01 | 1.13 | 192 | 0.36000007390976 | 1.747725725174 |