options

Functions

NameModuleCoverage (%)Time (s)Nb ThreadsGFLOP/sDeviation (coverage)Deviation (time)
gcciccicxgcciccicxgcciccicxgcciccicxgcciccicxgcciccicx
nbnxm_kernel_ElecEw_VdwLJCombLB_F_4xm(NbnxnPairlistCpu const*, nbnxn_atomdata_t const*, interaction_const_t const*, float const (*) [3], nbnxn_atomdata_output_t*)libgromacs_mpi.so.758.462.3561.31161.52181.4717811170.1064.9456.900.000.000.000.000.000.00
nbnxm_kernel_ElecEw_VdwLJCombLB_VF_4xm(NbnxnPairlistCpu const*, nbnxn_atomdata_t const*, interaction_const_t const*, float const (*) [3], nbnxn_atomdata_output_t*)libgromacs_mpi.so.79.499.519.4726.2527.6927.511175.4674.1067.040.000.000.000.000.000.00
gather_f_bsplines(gmx_pme_t const*, float const*, bool, PmeAtomComm const*, splinedata_t const*, float)libgromacs_mpi.so.73.723.33.510.299.610.1711129.4427.7930.060.000.000.000.000.000.00
spread_on_grid(gmx_pme_t const*, PmeAtomComm*, pmegrids_t const*, bool, bool, float*, bool, int) [clone ._omp_fn.1]libgromacs_mpi.so.74.62NANA12.79NANA1NANA7.69NANA0.00NANA0.00NANA
spread_on_grid(gmx_pme_t const*, PmeAtomComm*, pmegrids_t const*, bool, bool, float*, bool, int) [clone .extracted.11]libgromacs_mpi.so.7NANA4.16NANA12.09NANA1NANA8.41NANA0.00NANA0.00
nbnxn_kernel_prune_4xn(NbnxnPairlistCpu*, nbnxn_atomdata_t const*, gmx::ArrayRef<gmx::BasicVector<float> const>, float)libgromacs_mpi.so.71.761.231.044.883.593.0311135.0047.7656.360.000.000.000.000.000.00
solve_pme_yzx(gmx_pme_t const*, t_complex*, float, bool, int, int)libgromacs_mpi.so.71.80.580.764.991.672.2111117.0729.3837.730.000.000.000.000.000.00
_INTERNALef3c2910::spread_coefficients_bsplines_thread(pmegrid_t const*, PmeAtomComm const*, splinedata_t*, pme_spline_work*)libgromacs_mpi.so.7NA2.53NANA7.36NANA1NANA9.84NANA0.00NANA0.00NA
fft5d_execute(fft5d_plan_t*, int, gmx_wallcycle*)libgromacs_mpi.so.7002.12006.14111NANA0.020.000.000.000.000.000.00
gmx::lincs_matrix_expand(gmx::Lincs const&, gmx::Task const&, gmx::ArrayRef<float const>, gmx::ArrayRef<float>, gmx::ArrayRef<float>, gmx::ArrayRef<float>)libgromacs_mpi.so.7NANA1.91NANA5.54NANA1NANA3.20NANA0.00NANA0.00
gmx::lincs_matrix_expand(gmx::Lincs const&, gmx::Task const&, gmx::ArrayRef<float const>, gmx::ArrayRef<float>, gmx::ArrayRef<float>, gmx::ArrayRef<float>) [clone .isra.0]libgromacs_mpi.so.71.58NANA4.37NANA1NANA2.17NANA0.00NANA0.00NANA
_INTERNALef3c2910::make_bsplines(float**, float**, int, float (*) [3], int, int const*, float const*, bool)libgromacs_mpi.so.7NA1.58NANA4.61NANA1NANA10.93NANA0.00NANA0.00NA
_INTERNAL661916bb::gmx::lincs_matrix_expand(_INTERNAL661916bb::gmx::Lincs const&, _INTERNAL661916bb::gmx::Task const&, _INTERNAL661916bb::gmx::ArrayRef<float const>, _INTERNAL661916bb::gmx::ArrayRef<float>, _INTERNAL661916bb::gmx::Array...libgromacs_mpi.so.7NA1.49NANA4.33NANA1NANA2.19NANA0.00NANA0.00NA
PairlistSet::constructPairlists(gmx::InteractionLocality, Nbnxm::GridSet const&, gmx::ArrayRef<PairsearchWork>, nbnxn_atomdata_t*, gmx::ListOfLists<int> const&, int, t_nrnb*, SearchCycleCounting*) [clone .extracted.67]libgromacs_mpi.so.7NANA1.44NANA4.19NANA1NANA4.76NANA0.00NANA0.00
std::enable_if<((BondedKernelFlavor)0)==((BondedKernelFlavor)0), float>::type (anonymous namespace)::angles<(BondedKernelFlavor)0>(int, int const*, t_iparams const*, float const (*) [3], float (*) [4], float (*) [3], t_pbc const*, float, float*...libgromacs_mpi.so.70.66NA0.681.82NA1.981NA115.29NA14.120.00NA0.000.00NA0.00
fftwf_codelet_n1fv_15_avxlibfftw3f.so.3.5.50.640.67NA1.761.95NA11NA6.906.69NA0.000.00NA0.000.00NA
fftwf_codelet_hc2cfdftv_6_sse2libfftw3f.so.3.5.50.640.59NA1.781.72NA11NA7.707.52NA0.000.00NA0.000.00NA
fftwf_codelet_hc2cbdftv_2_sse2libfftw3f.so.3.5.50.630.58NA1.751.69NA11NA7.597.52NA0.000.00NA0.000.00NA
pbc_dx_aiuc(t_pbc const*, float const*, float const*, float*)libgromacs_mpi.so.70.430.320.421.180.921.21112.742.603.020.000.000.000.000.000.00
(anonymous namespace)::dih_angle_simd(float const (*) [3], int const*, int const*, int const*, int const*, float const*, gmx::SimdFloat*, gmx::SimdFloat*, gmx::SimdFloat*, gmx::SimdFloat*, gmx::SimdFloat*, gmx::SimdFloat*, gmx::SimdFloat*, gmx::SimdFloat*,...libgromacs_mpi.so.70.6NA0.491.66NA1.431NA122.87NA14.040.00NA0.000.00NA0.00
std::enable_if<((BondedKernelFlavor)0)==((BondedKernelFlavor)0), float>::type (anonymous namespace)::pdihs<(BondedKernelFlavor)0>(int, int const*, t_iparams const*, float const (*) [3], float (*) [4], float (*) [3], t_pbc const*, float, float*,...libgromacs_mpi.so.70.67NA0.371.86NA1.061NA115.25NA20.170.00NA0.000.00NA0.00
fftwf_cpy2dlibfftw3f.so.3.5.50.520.5NA1.431.45NA11NA0.887.49NA0.000.00NA0.000.00NA
fftwf_codelet_n1fv_11_avxlibfftw3f.so.3.5.50.470.46NA1.291.35NA11NA12.8712.36NA0.000.00NA0.000.00NA
fftwf_codelet_n1bv_16_sse2libfftw3f.so.3.5.50.470.44NA1.291.29NA11NA9.049.45NA0.000.00NA0.000.00NA
fftwf_codelet_t2fv_4_avxlibfftw3f.so.3.5.50.450.42NA1.241.22NA11NA13.1113.01NA0.000.00NA0.000.00NA
fftwf_codelet_t2bv_4_avxlibfftw3f.so.3.5.50.460.41NA1.271.2NA11NA13.2811.23NA0.000.00NA0.000.00NA
gmx::do_lincs(gmx::ArrayRefWithPadding<gmx::BasicVector<float> const>, gmx::ArrayRefWithPadding<gmx::BasicVector<float> >, float const (*) [3], t_pbc*, gmx::Lincs*, int, gmx::ArrayRef<float const>, t_commrec const*, bool, floa...libgromacs_mpi.so.70.84NANA2.31NANA1NANA6.98NANA0.00NANA0.00NANA
void gmx::settleTemplate<gmx::SimdFloat, gmx::SimdFBool, 8, float const*, true, false>(gmx::SettleData const&, int, int, float const*, float const*, float*, float, float*, float (*) [3], bool*) [clone .constprop.0]libgromacs_mpi.so.70.84NANA2.32NANA1NANA15.35NANA0.00NANA0.00NANA
makeClusterListSimd4xn(Nbnxm::Grid const&, NbnxnPairlistCpu*, int, int, int, bool, float const*, float, float, int*)libgromacs_mpi.so.70.84NANA2.31NANA1NANA4.66NANA0.00NANA0.00NANA
void gmx::settleTemplateWrapper<gmx::SimdFloat, gmx::SimdFBool, 8, float const*>(gmx::SettleData const&, int, int, float const*, float const*, float*, float, float*, bool, float (*) [3], bool*)libgromacs_mpi.so.7NANA0.83NANA2.41NANA1NANA16.57NANA0.00NANA0.00
gmx::lincs_update_atoms(gmx::Lincs*, int, float, gmx::ArrayRef<float const>, gmx::ArrayRef<gmx::BasicVector<float> const>, gmx::ArrayRef<float const>, float (*) [3])libgromacs_mpi.so.70.45NA0.371.24NA1.071NA19.74NA11.140.00NA0.000.00NA0.00
fftwf_codelet_n1bv_11_avxlibfftw3f.so.3.5.50.420.4NA1.171.17NA11NA13.688.51NA0.000.00NA0.000.00NA
__intel_avx_rep_memcpygmx_mpiNA0.440.37NA1.281.06NA11NA0.000.00NA0.000.00NA0.000.00
PairlistSet::constructPairlists(gmx::InteractionLocality, Nbnxm::GridSet const&, gmx::ArrayRef<PairsearchWork>, nbnxn_atomdata_t*, gmx::ListOfLists<int> const&, int, t_nrnb*, SearchCycleCounting*) [clone ._omp_fn.0]libgromacs_mpi.so.70.81NANA2.23NANA1NANA4.57NANA0.00NANA0.00NANA
do_pairs(int, int, int const*, t_iparams const*, float const (*) [3], float (*) [4], float (*) [3], t_pbc const*, float const*, float*, gmx::ArrayRef<float>, gmx::ArrayRef<float>, gmx::ArrayRef<bool>, gmx::ArrayRef<unsigned short>, ...libgromacs_mpi.so.70.700.071.9400.191115.76NA2.780.000.000.000.000.000.00
fftwf_codelet_n2fv_10_avxlibfftw3f.so.3.5.50.350.4NA0.951.15NA11NA14.7412.58NA0.000.00NA0.000.00NA
gmx::do_lincs(gmx::ArrayRefWithPadding<gmx::BasicVector<float> const>, gmx::ArrayRefWithPadding<gmx::BasicVector<float> >, float const (*) [3], t_pbc*, gmx::Lincs*, int, gmx::ArrayRef<float const>, t_commrec const*, bool, floa...libgromacs_mpi.so.7NANA0.73NANA2.13NANA1NANA7.65NANA0.00NANA0.00
mkl_dft_avx2_ownscDftFwd_Prime8_32fclibmkl_avx2.so.2NANA0.72NANA2.1NANA1NANA22.60NANA0.00NANA0.00
mkl_dft_avx2_ownscDftInv_Prime8_32fclibmkl_avx2.so.2NANA0.71NANA2.06NANA1NANA22.59NANA0.00NANA0.00
_INTERNALb629d8fd::makeClusterListSimd4xn(Nbnxm::Grid const&, NbnxnPairlistCpu*, int, int, int, bool, float const*, float, float, int*)libgromacs_mpi.so.7NA0.67NANA1.96NANA1NANA5.42NANA0.00NANA0.00NA
copy_rvec_to_nbat_real(int const*, int, int, float const (*) [3], int, float*, int)libgromacs_mpi.so.70.260.170.220.720.50.631110.000.000.000.000.000.000.000.000.00
__intel_avx_rep_memsetgmx_mpiNA0.250.4NA0.721.16NA11NA0.020.08NA0.000.00NA0.000.00
spread_on_grid(gmx_pme_t const*, PmeAtomComm*, pmegrids_t const*, bool, bool, float*, bool, int) [clone ._omp_fn.0]libgromacs_mpi.so.70.6NANA1.67NANA1NANA4.77NANA0.00NANA0.00NANA
_INTERNAL72b35b0f::(anonymous namespace)::dih_angle_simd(float const (*) [3], int const*, int const*, int const*, int const*, float const*, gmx::SimdFloat*, gmx::SimdFloat*, gmx::SimdFloat*, gmx::SimdFloat*, gmx::SimdFloat*, gmx::SimdFloat*, gmx::SimdFloat...libgromacs_mpi.so.7NA0.6NANA1.73NANA1NANA14.41NANA0.00NANA0.00NA
void _INTERNALb629d8fd::nbnxn_make_pairlist_part<NbnxnPairlistCpu>(Nbnxm::GridSet const&, Nbnxm::Grid const&, Nbnxm::Grid const&, PairsearchWork*, nbnxn_atomdata_t const*, gmx::ListOfLists<int> const&, float, PairlistType, int, ...libgromacs_mpi.so.7NA0.6NANA1.75NANA1NANA5.37NANA0.00NANA0.00NA
void _INTERNAL251c4d10::do_pairs_simple<gmx::SimdFloat, 8, float const*>(int, int const*, t_iparams const*, float const (*) [3], float (*) [4], float const*, gmx::ArrayRef<float>, float)libgromacs_mpi.so.7NA0.58NANA1.67NANA1NANA6.43NANA0.00NANA0.00NA
spread_on_grid(gmx_pme_t const*, PmeAtomComm*, pmegrids_t const*, bool, bool, float*, bool, int) [clone .extracted.18]libgromacs_mpi.so.7NANA0.56NANA1.63NANA1NANA5.50NANA0.00NANA0.00
void do_pairs_simple<gmx::SimdFloat, 8, float const*>(int, int const*, t_iparams const*, float const (*) [3], float (*) [4], float const*, gmx::ArrayRef<float>, float)libgromacs_mpi.so.7NANA0.55NANA1.59NANA1NANA6.77NANA0.00NANA0.00
copy_pmegrid_to_fftgrid(gmx_pme_t const*, float const*, float*, int)libgromacs_mpi.so.70.470.020.011.30.070.041110.000.000.000.000.000.000.000.000.00
_INTERNALef3c2910::calc_interpolation_idx(gmx_pme_t const*, PmeAtomComm*, int, int, int, int)libgromacs_mpi.so.7NA0.49NANA1.44NANA1NANA6.48NANA0.00NANA0.00NA
std::enable_if<((BondedKernelFlavor)0)==((BondedKernelFlavor)0), float>::type _INTERNAL72b35b0f::(anonymous namespace)::angles<(BondedKernelFlavor)0>(int, int const*, t_iparams const*, float const (*) [3], float (*) [4], float (*) [3], t_pbc co...libgromacs_mpi.so.7NA0.49NANA1.43NANA1NANA14.96NANA0.00NANA0.00NA
void _INTERNALa35aedc8::gmx::settleTemplate<_INTERNALa35aedc8::gmx::SimdFloat, _INTERNALa35aedc8::gmx::SimdFBool, 8, float const*, true, false>(_INTERNALa35aedc8::gmx::SettleData const&, int, int, float const*, float const*, float*, float, float*...libgromacs_mpi.so.7NA0.47NANA1.38NANA1NANA12.47NANA0.00NANA0.00NA
fftwf_codelet_n2bv_10_avxlibfftw3f.so.3.5.50.230.24NA0.630.71NA11NA21.2818.52NA0.000.00NA0.000.00NA
_INTERNAL661916bb::gmx::lincs_update_atoms_noind(int, _INTERNAL661916bb::gmx::ArrayRef<_INTERNAL661916bb::gmx::AtomPair const>, float, _INTERNAL661916bb::gmx::ArrayRef<float const>, _INTERNAL661916bb::gmx::ArrayRef<_INTERNAL661916bb::gmx::Ba...libgromacs_mpi.so.7NA0.45NANA1.31NANA1NANA5.58NANA0.00NANA0.00NA
dih_angle(float const*, float const*, float const*, float const*, t_pbc const*, float*, float*, float*, float*, float*, int*, int*, int*)libgromacs_mpi.so.70.130.160.130.350.450.361112.602.842.770.000.000.000.000.000.00
void _INTERNALa35aedc8::gmx::__regcall3__gatherLoadUTranspose<3>(float const*, int const*, _INTERNALa35aedc8::gmx::SimdFloat*, _INTERNALa35aedc8::gmx::SimdFloat*, _INTERNALa35aedc8::gmx::SimdFloat*)libgromacs_mpi.so.7NA0.41NANA1.18NANA1NANA14.72NANA0.00NANA0.00NA
copy_fftgrid_to_pmegrid(gmx_pme_t*, float const*, float*, int, int, int)libgromacs_mpi.so.70.340.030.010.940.070.041110.000.020.060.000.000.000.000.000.00
gmx::Update::Impl::update_coords(t_inputrec const&, long, int, bool, gmx::ArrayRef<ParticleType const>, gmx::ArrayRef<float const>, gmx::ArrayRef<float const [3]>, t_state*, gmx::ArrayRefWithPadding<gmx::BasicVector<float> co...libgromacs_mpi.so.70.35NANA0.97NANA1NANA9.32NANA0.00NANA0.00NANA
std::enable_if<((BondedKernelFlavor)0)==((BondedKernelFlavor)0), float>::type _INTERNAL72b35b0f::(anonymous namespace)::pdihs<(BondedKernelFlavor)0>(int, int const*, t_iparams const*, float const (*) [3], float (*) [4], float (*) [3], t_pbc con...libgromacs_mpi.so.7NA0.35NANA1.01NANA1NANA20.38NANA0.00NANA0.00NA
__memset_avx2_unaligned_ermslibc-2.28.so0.35NA00.98NA01NA10.01NANA0.00NA0.000.00NA0.00
mkl_dft_avx2_ipps_cFFTfwd_64_32fclibmkl_avx2.so.2NANA0.35NANA1.02NANA1NANA12.58NANA0.00NANA0.00
_INTERNAL7abe0478::gmx::SimdFloat _INTERNAL7abe0478::gmx::__regcall3__exp<(MathOptimization)0>(_INTERNAL7abe0478::gmx::SimdFloat)libgromacs_mpi.so.7NA0.34NANA0.98NANA1NANA43.55NANA0.00NANA0.00NA
_INTERNAL661916bb::gmx::__regcall3__calc_dr_x_xp_simd(int, int, _INTERNAL661916bb::gmx::ArrayRef<_INTERNAL661916bb::gmx::AtomPair const>, float const (*) [3], float const (*) [3], float const*, float const*, float const*, float (*) [3], float*, floa...libgromacs_mpi.so.7NA0.34NANA0.98NANA1NANA8.18NANA0.00NANA0.00NA
mkl_dft_avx2_ownscDftFwd_Fact4_32fclibmkl_avx2.so.2NANA0.33NANA0.95NANA1NANA6.37NANA0.00NANA0.00
_ZN12_GLOBAL__N_124do_dih_fup_noshiftf_simdEPKiS1_S1_S1_N3gmx9SimdFloatES3_S3_S3_S3_S3_S3_S3_PA4_f@@296libgromacs_mpi.so.7NANA0.33NANA0.95NANA1NANA26.17NANA0.00NANA0.00
mkl_dft_avx2_ownscDftInv_Fact3_32fclibmkl_avx2.so.2NANA0.33NANA0.95NANA1NANA17.86NANA0.00NANA0.00
gmx::Update::Impl::update_coords(t_inputrec const&, long, int, bool, gmx::ArrayRef<ParticleType const>, gmx::ArrayRef<float const>, gmx::ArrayRef<float const [3]>, t_state*, gmx::ArrayRefWithPadding<gmx::BasicVector<float> co...libgromacs_mpi.so.7NANA0.32NANA0.94NANA1NANA9.56NANA0.00NANA0.00
std::enable_if<std::is_same<float [3], float [3]>::value||std::is_same<float [3], float const [3]>::value, void>::type _INTERNALf921b9f2::updateMDLeapfrogSimpleSimd<(StoreUpdatedVelocities)0, float [3]>(int, int, float, gmx::ArrayRe...libgromacs_mpi.so.7NA0.31NANA0.9NANA1NANA8.49NANA0.00NANA0.00NA
bond_angle(float const*, float const*, float const*, t_pbc const*, float*, float*, float*, int*, int*)libgromacs_mpi.so.70.110.080.120.290.230.361112.732.854.940.000.000.000.000.000.00
mkl_dft_avx2_ownscDftFwd_Fact3_32fclibmkl_avx2.so.2NANA0.31NANA0.9NANA1NANA18.69NANA0.00NANA0.00
mkl_dft_avx2_ownscDftInv_Fact4_32fclibmkl_avx2.so.2NANA0.31NANA0.9NANA1NANA5.78NANA0.00NANA0.00
evaluate_single(float, float, float const*, float, float, float, float, float*, float*)libgromacs_mpi.so.70.19NA0.120.52NA0.351NA12.42NA2.800.00NA0.000.00NA0.00
_INTERNAL72b35b0f::(anonymous namespace)::__regcall3__do_dih_fup_noshiftf_simd(int const*, int const*, int const*, int const*, gmx::SimdFloat, gmx::SimdFloat, gmx::SimdFloat, gmx::SimdFloat, gmx::SimdFloat, gmx::SimdFloat, gmx::SimdFloat, gmx::SimdFloat, f...libgromacs_mpi.so.7NA0.3NANA0.87NANA1NANA24.19NANA0.00NANA0.00NA
_INTERNAL661916bb::gmx::do_lincs(_INTERNAL661916bb::gmx::ArrayRefWithPadding<_INTERNAL661916bb::gmx::BasicVector<float> const>, _INTERNAL661916bb::gmx::ArrayRefWithPadding<_INTERNAL661916bb::gmx::BasicVector<float> >, float const (*...libgromacs_mpi.so.7NA0.3NANA0.87NANA1NANA4.47NANA0.00NANA0.00NA
gmx::ThreadForceBuffer<float [4]>::clearForcesAndEnergies()libgromacs_mpi.so.70.160.060.070.440.180.21110.000.000.000.000.000.000.000.000.00
mkl_dft_avx2_owns_cCcsRecombine_32flibmkl_avx2.so.2NANA0.29NANA0.84NANA1NANA12.48NANA0.00NANA0.00
fftwf_mkplan_hc2clibfftw3f.so.3.5.50.150.13NA0.420.38NA11NA7.688.39NA0.000.00NA0.000.00NA
mkl_dft_avx2_owns_cRealRecombine_32flibmkl_avx2.so.2NANA0.24NANA0.69NANA1NANA17.89NANA0.00NANA0.00
mkl_dft_avx2_ipps_cFFTinv_64_32fclibmkl_avx2.so.2NANA0.22NANA0.63NANA1NANA22.52NANA0.00NANA0.00
float _INTERNAL251c4d10::do_pairs_general<(BondedKernelFlavor)2>(int, int, int const*, t_iparams const*, float const (*) [3], float (*) [4], float (*) [3], t_pbc const*, float const*, float*, gmx::ArrayRef<float>, gmx::ArrayRef<float>, gm...libgromacs_mpi.so.7NA0.22NANA0.64NANA1NANA2.73NANA0.00NANA0.00NA
std::enable_if<(((BondedKernelFlavor)2)!=((BondedKernelFlavor)0))||(!(1)), float>::type _INTERNAL72b35b0f::(anonymous namespace)::pdihs<(BondedKernelFlavor)2>(int, int const*, t_iparams const*, float const (*) [3], float (*) [4], float (*) [3],...libgromacs_mpi.so.7NA0.21NANA0.6NANA1NANA2.31NANA0.00NANA0.00NA
reduceForces(nbnxn_atomdata_t*, gmx::AtomLocality, Nbnxm::GridSet const&, float (*) [3]) [clone .extracted]libgromacs_mpi.so.7NANA0.2NANA0.57NANA1NANA1.46NANA0.00NANA0.00
std::enable_if<(((BondedKernelFlavor)2)!=((BondedKernelFlavor)0))||(!(1)), float>::type (anonymous namespace)::angles<(BondedKernelFlavor)2>(int, int const*, t_iparams const*, float const (*) [3], float (*) [4], float (*) [3], t_pbc const*, flo...libgromacs_mpi.so.70.11NA0.090.31NA0.251NA13.13NA2.350.00NA0.000.00NA0.00
reduceForces(nbnxn_atomdata_t*, gmx::AtomLocality, Nbnxm::GridSet const&, float (*) [3]) [clone ._omp_fn.0]libgromacs_mpi.so.70.17NANA0.48NANA1NANA1.76NANA0.00NANA0.00NANA
_INTERNAL95fec573::nbnxn_atomdata_add_nbat_f_to_f_part(Nbnxm::GridSet const&, nbnxn_atomdata_t const&, nbnxn_atomdata_output_t const&, int, int, float (*) [3])libgromacs_mpi.so.7NA0.17NANA0.5NANA1NANA1.76NANA0.00NANA0.00NA
__memcpy_avx_unaligned_ermslibc-2.28.so0.090.08NA0.250.22NA11NA18.1920.69NA0.000.00NA0.000.00NA
__erfcflibm-2.28.so0.16NANA0.44NANA1NANA2.64NANA0.00NANA0.00NANA
_INTERNALcfff3329::energyDrift(gmx::ArrayRef<VerletbufAtomtype const>, gmx_ffparams_t const*, float, pot_derivatives_t const*, pot_derivatives_t const*, pot_derivatives_t const*, float, float, float, float)libgromacs_mpi.so.7NA0.16NANA0.46NANA1NANA3.08NANA0.00NANA0.00NA
wrap_periodic_pmegrid(gmx_pme_t const*, float*)libgromacs_mpi.so.70.050.060.050.130.170.131111.581.241.550.000.000.000.000.000.00
fftwf_codelet_r2cf_7libfftw3f.so.3.5.50.080.07NA0.230.21NA11NA6.277.60NA0.000.00NA0.000.00NA
setupForceOutputs(ForceHelperBuffers*, gmx::ArrayRefWithPadding<gmx::BasicVector<float> >, gmx::DomainLifetimeWorkload const&, gmx::StepWorkload const&, bool, gmx_wallcycle*)libgromacs_mpi.so.7NANA0.15NANA0.44NANA1NANA0.00NANA0.00NANA0.00
energyDriftAtomPair(bool, bool, float, float, float, float, pot_derivatives_t const*)libgromacs_mpi.so.70.06NA0.090.17NA0.271NA12.43NA4.380.00NA0.000.00NA0.00
DftiComputeBackwardlibmkl_intel_lp64.so.2NANA0.15NANA0.43NANA1NANA26.46NANA0.00NANA0.00
__atanflibm-2.28.so0.15NANA0.4NANA1NANA2.67NANA0.00NANA0.00NANA
fftwf_rdft2_buffered_registerlibfftw3f.so.3.5.50.070.07NA0.190.21NA11NA7.526.57NA0.000.00NA0.000.00NA
clearForceBuffer(nbnxn_atomdata_t*, int)libgromacs_mpi.so.7NA0.140NA0.40NA11NA0.00NANA0.000.00NA0.000.00
void do_dih_fup<(BondedKernelFlavor)2>(int, int, int, int, float, float*, float*, float*, float*, float*, float (*) [4], float (*) [3], t_pbc const*, float const (*) [3], int, int, int)libgromacs_mpi.so.7NANA0.13NANA0.37NANA1NANA2.85NANA0.00NANA0.00
__libm_atan2f_l9libgromacs_mpi.so.7NA0.12NANA0.35NANA1NANA2.48NANA0.00NANA0.00NA
void do_dih_fup<(BondedKernelFlavor)2>(int, int, int, int, float, float*, float*, float*, float*, float*, float (*) [4], float (*) [3], t_pbc const*, float const (*) [3], int, int, int) [clone .isra.0]libgromacs_mpi.so.70.12NANA0.34NANA1NANA3.36NANA0.00NANA0.00NANA
std::enable_if<(((BondedKernelFlavor)2)!=((BondedKernelFlavor)0))||(!(1)), float>::type _INTERNAL72b35b0f::(anonymous namespace)::angles<(BondedKernelFlavor)2>(int, int const*, t_iparams const*, float const (*) [3], float (*) [4], float (*) [3]...libgromacs_mpi.so.7NA0.12NANA0.33NANA1NANA3.14NANA0.00NANA0.00NA
DftiComputeForwardlibmkl_intel_lp64.so.2NANA0.11NANA0.3NANA1NANA29.93NANA0.00NANA0.00
__libm_sincosf_e7gmx_mpiNANA0.11NANA0.32NANA1NANA2.55NANA0.00NANA0.00
mkl_dft_avx2_ownscDftInv_PrimeFact_32fclibmkl_avx2.so.2NANA0.11NANA0.31NANA1NANA19.69NANA0.00NANA0.00
L__ZN17_INTERNALd56b7fc33gmx12_GLOBAL__N_124reduceThreadForceBuffersIA4_fEEvNS0_8ArrayRefINS0_11BasicVectorIfEEEENS4_ISt10unique_ptrINS0_17ThreadForceBufferIT_EESt14default_deleteISB_EEEENS4_IKSt5arrayImLm2EEEENS4_IKiEE_170__par_region0_2_134libgromacs_mpi.so.7NA0.11NANA0.31NANA1NANA1.52NANA0.00NANA0.00NA
calc_ke_part_normal(gmx::ArrayRef<gmx::BasicVector<float> const>, t_grpopts const*, t_mdatoms const*, gmx_ekindata_t*, t_nrnb*, bool) [clone ._omp_fn.0]libgromacs_mpi.so.70.11NANA0.3NANA1NANA8.75NANA0.00NANA0.00NANA
_INTERNAL14e05f89::setupForceOutputs(ForceHelperBuffers*, gmx::ArrayRefWithPadding<gmx::BasicVector<float> >, gmx::DomainLifetimeWorkload const&, gmx::StepWorkload const&, bool, gmx_wallcycle*)libgromacs_mpi.so.7NA0.11NANA0.32NANA1NANA0.00NANA0.00NANA0.00NA
fftwf_codelet_r2cb_3libfftw3f.so.3.5.50.050.06NA0.130.18NA11NA10.778.51NA0.000.00NA0.000.00NA
fftwf_mkplan_dftwlibfftw3f.so.3.5.50.050.06NA0.130.16NA11NA13.7710.38NA0.000.00NA0.000.00NA
std::enable_if<(((BondedKernelFlavor)2)!=((BondedKernelFlavor)0))||(!(1)), float>::type (anonymous namespace)::pdihs<(BondedKernelFlavor)2>(int, int const*, t_iparams const*, float const (*) [3], float (*) [4], float (*) [3], t_pbc const*, floa...libgromacs_mpi.so.70.02NA0.080.06NA0.241NA13.21NA2.840.00NA0.000.00NA0.00
__acosf_finitelibm-2.28.so0.1NANA0.26NANA1NANA3.17NANA0.00NANA0.00NANA
__libm_erfcf_exgmx_mpiNANA0.1NANA0.28NANA1NANA2.92NANA0.00NANA0.00
gmx::Update::Impl::finish_update(t_inputrec const&, bool, int, gmx::ArrayRef<unsigned short const>, t_state*, gmx_wallcycle*, bool) [clone .extracted]libgromacs_mpi.so.7NANA0.1NANA0.3NANA1NANA0.00NANA0.00NANA0.00
_INTERNAL661916bb::gmx::__regcall3__calc_dist_iter_simd(int, int, _INTERNAL661916bb::gmx::ArrayRef<_INTERNAL661916bb::gmx::AtomPair const>, float const (*) [3], float const*, float const*, float const*, float, float*, float*, bool*)libgromacs_mpi.so.7NA0.1NANA0.3NANA1NANA16.32NANA0.00NANA0.00NA
fftwf_codelet_r2cfII_7libfftw3f.so.3.5.50.040.06NA0.110.17NA11NA12.536.93NA0.000.00NA0.000.00NA
L__ZN17_INTERNAL7742301e19calc_ke_part_normalEN3gmx8ArrayRefIKNS0_11BasicVectorIfEEEEPK9t_grpoptsPK9t_mdatomsP14gmx_ekindata_tP6t_nrnbb_113__par_region0_2_15libgromacs_mpi.so.7NA0.1NANA0.29NANA1NANA8.97NANA0.00NANA0.00NA
reduced_sincoslibm-2.28.so0.09NANA0.24NANA1NANA2.25NANA0.00NANA0.00NANA
fftwf_ct_genericbuf_registerlibfftw3f.so.3.5.50.050.04NA0.130.13NA11NA12.0210.64NA0.000.00NA0.000.00NA
__GI___printf_fp_llibc-2.28.so0.030.030.030.070.10.071110.000.000.000.000.000.000.000.000.00
void gmx::settleTemplate<gmx::SimdFloat, gmx::SimdFBool, 8, float const*, true, true>(gmx::SettleData const&, int, int, float const*, float const*, float*, float, float*, float (*) [3], bool*)libgromacs_mpi.so.70.08NANA0.23NANA1NANA20.39NANA0.00NANA0.00NANA
approx_2dof(float, float, float*, float*)libgromacs_mpi.so.70.08NANA0.22NANA1NANA2.38NANA0.00NANA0.00NANA
void gmx::(anonymous namespace)::reduceThreadForceBuffers<float [4]>(gmx::ArrayRef<gmx::BasicVector<float> >, gmx::ArrayRef<std::unique_ptr<gmx::ThreadForceBuffer<float [4]>, std::default_delete<gmx::ThreadForceBuffer<fl...libgromacs_mpi.so.7NANA0.08NANA0.24NANA1NANA3.47NANA0.00NANA0.00
gmx::Update::Impl::finish_update(t_inputrec const&, bool, int, gmx::ArrayRef<unsigned short const>, t_state*, gmx_wallcycle*, bool) [clone ._omp_fn.0]libgromacs_mpi.so.70.08NANA0.22NANA1NANA0.00NANA0.00NANA0.00NANA
calc_ke_part_normal(gmx::ArrayRef<gmx::BasicVector<float> const>, t_grpopts const*, t_mdatoms const*, gmx_ekindata_t*, t_nrnb*, bool) [clone .extracted]libgromacs_mpi.so.7NANA0.08NANA0.24NANA1NANA9.96NANA0.00NANA0.00
__libm_atan2f_l9gmx_mpiNANA0.08NANA0.23NANA1NANA3.74NANA0.00NANA0.00
__ieee754_exp_fmalibm-2.28.so0.08NANA0.21NANA1NANA3.00NANA0.00NANA0.00NANA
void _INTERNAL72b35b0f::gmx::__regcall3__transposeScatterIncrU<4>(float*, int const*, _INTERNAL72b35b0f::gmx::SimdFloat, _INTERNAL72b35b0f::gmx::SimdFloat, _INTERNAL72b35b0f::gmx::SimdFloat)libgromacs_mpi.so.7NA0.08NANA0.23NANA1NANA17.72NANA0.00NANA0.00NA
__libm_sse2_sincosflibgromacs_mpi.so.7NA0.08NANA0.23NANA1NANA2.99NANA0.00NANA0.00NA
fftwf_codelet_r2cbIII_3libfftw3f.so.3.5.50.040.04NA0.120.12NA11NA4.844.57NA0.000.00NA0.000.00NA
void gmx::(anonymous namespace)::reduceThreadForceBuffers<float [4]>(gmx::ArrayRef<gmx::BasicVector<float> >, gmx::ArrayRef<std::unique_ptr<gmx::ThreadForceBuffer<float [4]>, std::default_delete<gmx::ThreadForceBuffer<fl...libgromacs_mpi.so.70.08NANA0.21NANA1NANA3.51NANA0.00NANA0.00NANA
mkl_dft_avx2_ownscDftFwd_PrimeFact_32fclibmkl_avx2.so.2NANA0.08NANA0.22NANA1NANA27.27NANA0.00NANA0.00
_INTERNALb629d8fd::setExclusionsForIEntry(Nbnxm::GridSet const&, NbnxnPairlistCpu*, bool, int, nbnxn_ci_t const&, gmx::ListOfLists<int> const&)libgromacs_mpi.so.7NA0.08NANA0.24NANA1NANA8.45NANA0.00NANA0.00NA
Unknown functionlibgromacs_mpi.so.70.010.030.040.040.080.121114.222.163.560.000.000.000.000.000.00
fftwf_khc2c_registerlibfftw3f.so.3.5.50.050.03NA0.120.08NA11NA4.617.73NA0.000.00NA0.000.00NA
int _INTERNALd64f4cfb::assignInteractionsForAtom<true>(AtomIndexSet const&, reverse_ilist_t const&, gmx_ga2la_t const&, gmx_domdec_zones_t const&, bool, int const*, bool, float, t_pbc const*, gmx::ArrayRef<gmx::BasicVector<float...libgromacs_mpi.so.7NA0.07NANA0.19NANA1NANA0.00NANA0.00NANA0.00NA
_INTERNALb629d8fd::closeIEntry(NbnxnPairlistCpu*, int, bool, float, int, int)libgromacs_mpi.so.7NA0.07NANA0.19NANA1NANA7.51NANA0.00NANA0.00NA
__libm_exp_l9libgromacs_mpi.so.7NA0.07NANA0.21NANA1NANA1.95NANA0.00NANA0.00NA
__libm_acosf_l9libgromacs_mpi.so.7NA0.07NANA0.19NANA1NANA2.63NANA0.00NANA0.00NA
L__ZN3gmx6Update4Impl13finish_updateERK10t_inputrecbiNS_8ArrayRefIKtEEP7t_stateP13gmx_wallcycleb_1637__par_region0_2_160libgromacs_mpi.so.7NA0.07NANA0.19NANA1NANA0.00NANA0.00NANA0.00NA
mkl_serv_verbose_modelibmkl_core.so.2NANA0.07NANA0.19NANA1NANA18.86NANA0.00NANA0.00
__expf_fmalibm-2.28.so0.07NANA0.21NANA1NANA1.92NANA0.00NANA0.00NANA
setupForceOutputs(ForceHelperBuffers*, gmx::ArrayRefWithPadding<gmx::BasicVector<float> >, gmx::DomainLifetimeWorkload const&, gmx::StepWorkload const&, bool, gmx_wallcycle*) [clone .constprop.0]libgromacs_mpi.so.70.07NANA0.2NANA1NANA0.00NANA0.00NANA0.00NANA
std::enable_if<((BondedKernelFlavor)0)==((BondedKernelFlavor)0), float>::type (anonymous namespace)::rbdihs<(BondedKernelFlavor)0>(int, int const*, t_iparams const*, float const (*) [3], float (*) [4], float (*) [3], t_pbc const*, float, float*...libgromacs_mpi.so.70.05NA0.020.14NA0.061NA113.87NA32.710.00NA0.000.00NA0.00
fftwf_dft_conf_standardlibfftw3f.so.3.5.50.030.04NA0.090.11NA11NA10.658.76NA0.000.00NA0.000.00NA
calc_x_times_f(int, float const (*) [3], float const (*) [3], bool, float const (*) [3], float (*) [3])libgromacs_mpi.so.70.06NANA0.17NANA1NANA6.06NANA0.00NANA0.00NANA
int assignInteractionsForAtom<true>(AtomIndexSet const&, reverse_ilist_t const&, gmx_ga2la_t const&, gmx_domdec_zones_t const&, bool, int const*, bool, float, t_pbc const*, gmx::ArrayRef<gmx::BasicVector<float> const>, Int...libgromacs_mpi.so.70.06NANA0.17NANA1NANA0.00NANA0.00NANA0.00NANA
Nbnxm::Grid::fillCell(Nbnxm::GridSetData*, nbnxn_atomdata_t*, int, int, gmx::ArrayRef<long const>, gmx::ArrayRef<gmx::BasicVector<float> const>, Nbnxm::BoundingBox*)libgromacs_mpi.so.70.020.010.030.060.030.071110.000.000.000.000.000.000.000.000.00
calc_vir(int, float const (*) [3], float const (*) [3], float (*) [3], bool, float const (*) [3])libgromacs_mpi.so.7NA0.040.02NA0.10.07NA11NA10.2014.55NA0.000.00NA0.000.00
unwrap_periodic_pmegrid(gmx_pme_t*, float*)libgromacs_mpi.so.70.010.030.020.030.10.051110.000.000.000.000.000.000.000.000.00
globalAtomIndexToMoltypeIndices(gmx::ArrayRef<MolblockIndices const>, int)libgromacs_mpi.so.70.020.020.020.050.040.051110.000.000.000.000.000.000.000.000.00
fftwf_dft_solvelibfftw3f.so.3.5.50.040.02NA0.110.06NA11NA7.9115.65NA0.000.00NA0.000.00NA
_IO_vfprintflibc-2.28.so0.010.020.020.030.040.061110.000.000.000.000.000.000.000.000.00
compute_1d_small_fwdlibmkl_avx2.so.2NANA0.05NANA0.15NANA1NANA31.03NANA0.00NANA0.00
calcVerletBufferSize(gmx_mtop_t const&, float, t_inputrec const&, int, int, float, VerletbufListSetup const&)libgromacs_mpi.so.70.03NA0.020.07NA0.061NA11.84NA3.520.00NA0.000.00NA0.00
compute_1d_small_bwdlibmkl_avx2.so.2NANA0.05NANA0.14NANA1NANA19.46NANA0.00NANA0.00
__libm_exp_l9gmx_mpiNANA0.05NANA0.15NANA1NANA3.17NANA0.00NANA0.00
mkl_dft_avx2_ippsFFTInv_CCSToR_32flibmkl_avx2.so.2NANA0.05NANA0.15NANA1NANA22.34NANA0.00NANA0.00
__libm_erfcf_exlibgromacs_mpi.so.7NA0.05NANA0.15NANA1NANA4.38NANA0.00NANA0.00NA
_INTERNALa35aedc8::__regcall3__pbc_dx_aiuc(float const*, gmx::SimdFloat const*, gmx::SimdFloat const*, gmx::SimdFloat*)libgromacs_mpi.so.7NA0.05NANA0.15NANA1NANA16.09NANA0.00NANA0.00NA
void _INTERNAL72b35b0f::gmx::__regcall3__transposeScatterDecrU<4>(float*, int const*, _INTERNAL72b35b0f::gmx::SimdFloat, _INTERNAL72b35b0f::gmx::SimdFloat, _INTERNAL72b35b0f::gmx::SimdFloat)libgromacs_mpi.so.7NA0.05NANA0.14NANA1NANA14.58NANA0.00NANA0.00NA
float (anonymous namespace)::dopdihs<(BondedKernelFlavor)2>(float, float, float, float, int, float, float, float*, float*)libgromacs_mpi.so.70.05NANA0.12NANA1NANA2.80NANA0.00NANA0.00NANA
void _INTERNALa35aedc8::gmx::settleTemplate<_INTERNALa35aedc8::gmx::SimdFloat, _INTERNALa35aedc8::gmx::SimdFBool, 8, float const*, true, true>(_INTERNALa35aedc8::gmx::SettleData const&, int, int, float const*, float const*, float*, float, float*,...libgromacs_mpi.so.7NA0.05NANA0.16NANA1NANA17.67NANA0.00NANA0.00NA
__atan2f_finitelibm-2.28.so0.04NANA0.11NANA1NANA2.08NANA0.00NANA0.00NANA
__libm_acosf_l9gmx_mpiNANA0.04NANA0.1NANA1NANA2.76NANA0.00NANA0.00
unwrap_periodic_pmegrid(gmx_pme_t*, float*) [clone .extracted]libgromacs_mpi.so.7NANA0.04NANA0.11NANA1NANA0.00NANA0.00NANA0.00
__libm_expf_l9gmx_mpiNANA0.04NANA0.12NANA1NANA3.07NANA0.00NANA0.00
_INTERNALf921b9f2::do_update_md(int, int, float, long, float const (*) [3], float (*) [3], float (*) [3], float const (*) [3], TemperatureCoupling, PressureCoupling, int, int, gmx::ArrayRef<unsigned short const>, bool, gmx::ArrayRef<unsigned short...libgromacs_mpi.so.7NA0.04NANA0.12NANA1NANA7.09NANA0.00NANA0.00NA
__sincosf_fmalibm-2.28.so0.04NANA0.12NANA1NANA2.45NANA0.00NANA0.00NANA
__libm_expf_l9libgromacs_mpi.so.7NA0.04NANA0.12NANA1NANA3.04NANA0.00NANA0.00NA
atoms2md(gmx_mtop_t const&, t_inputrec const&, int, gmx::ArrayRef<int>, int, gmx::MDAtoms*) [clone ._omp_fn.0]libgromacs_mpi.so.70.03NANA0.09NANA1NANA0.06NANA0.00NANA0.00NANA
atoms2md(gmx_mtop_t const&, t_inputrec const&, int, gmx::ArrayRef<int>, int, gmx::MDAtoms*)libgromacs_mpi.so.7NA0.03NANA0.09NANA1NANA0.00NANA0.00NANA0.00NA
void _INTERNALd64f4cfb::make_exclusions_zone<true>(gmx::ArrayRef<int const>, gmx_ga2la_t const&, gmx_domdec_zones_t const&, gmx::ArrayRef<MolblockIndices const>, std::vector<gmx_moltype_t, std::allocator<gmx_moltype_t> &g...libgromacs_mpi.so.7NA0.03NANA0.1NANA1NANA0.00NANA0.00NANA0.00NA
_INTERNALcd96ede4::atoms_to_settles(gmx_domdec_t*, gmx_mtop_t const&, gmx::ArrayRef<long const>, gmx::ArrayRef<std::vector<int, std::allocator<int> > const>, int, int, InteractionList*, std::vector<int, std::allocator<int&...libgromacs_mpi.so.7NA0.03NANA0.08NANA1NANA0.00NANA0.00NANA0.00NA
mkl_dft_avx2_ippsFFTFwd_RToPerm_32flibmkl_avx2.so.2NANA0.03NANA0.1NANA1NANA18.44NANA0.00NANA0.00
mkl_dft_avx2_ippsDFTInv_CToC_32fclibmkl_avx2.so.2NANA0.03NANA0.09NANA1NANA36.08NANA0.00NANA0.00
mkl_dft_avx2_ippsDFTFwd_CToC_32fclibmkl_avx2.so.2NANA0.03NANA0.09NANA1NANA33.90NANA0.00NANA0.00
dd_make_local_constraints(gmx_domdec_t*, int, gmx_mtop_t const&, gmx::ArrayRef<long const>, gmx::Constraints*, int, gmx::ArrayRef<InteractionList>) [clone .extracted]libgromacs_mpi.so.7NANA0.03NANA0.07NANA1NANA0.00NANA0.00NANA0.00
void make_exclusions_zone<true>(gmx::ArrayRef<int const>, gmx_ga2la_t const&, gmx_domdec_zones_t const&, gmx::ArrayRef<MolblockIndices const>, std::vector<gmx_moltype_t, std::allocator<gmx_moltype_t> > const&, gmx:...libgromacs_mpi.so.70.03NANA0.07NANA1NANA0.00NANA0.00NANA0.00NANA
__atan2flibm-2.28.so0.03NANA0.07NANA1NANA2.04NANA0.00NANA0.00NANA
mkl_dft_avx2_ippsDFTFwd_RToCCS_32flibmkl_avx2.so.2NANA0.03NANA0.09NANA1NANA27.83NANA0.00NANA0.00
nral_rt(int)libgromacs_mpi.so.70.0100.020.010.010.061110.000.000.000.000.000.000.000.000.00
void make_exclusions_zone<true>(gmx::ArrayRef<int const>, gmx_ga2la_t const&, gmx_domdec_zones_t const&, gmx::ArrayRef<MolblockIndices const>, std::vector<gmx_moltype_t, std::allocator<gmx_moltype_t> > const&, gmx:...libgromacs_mpi.so.7NANA0.03NANA0.07NANA1NANA0.00NANA0.00NANA0.00
int assignInteractionsForAtom<true>(AtomIndexSet const&, reverse_ilist_t const&, gmx_ga2la_t const&, gmx_domdec_zones_t const&, bool, int const*, bool, float, t_pbc const*, gmx::ArrayRef<gmx::BasicVector<float> const>, Int...libgromacs_mpi.so.7NANA0.03NANA0.08NANA1NANA0.00NANA0.00NANA0.00
_IO_file_xsputnlibc-2.28.so0.010.010.010.020.020.021110.000.000.000.000.000.000.000.000.00
gmx::dd_partition_system(_IO_FILE*, gmx::MDLogger const&, long, t_commrec const*, bool, int, t_state*, gmx_mtop_t const&, t_inputrec const&, gmx::ImdSession*, pull_t*, t_state*, gmx::ForceBuffers*, gmx::MDAtoms*, gmx_localtop_t*, t_forcerec*, g...libgromacs_mpi.so.70.01NA0.020.01NA0.061NA10.00NA0.000.00NA0.000.00NA0.00
gmx_fft_1d(gmx_fft*, gmx_fft_direction, void*, void*)libgromacs_mpi.so.7NANA0.03NANA0.07NANA1NANA34.93NANA0.00NANA0.00
mkl_dft_avx2_ippsDFTInv_CCSToR_32flibmkl_avx2.so.2NANA0.02NANA0.07NANA1NANA21.39NANA0.00NANA0.00
fftwf_transposelibfftw3f.so.3.5.50.010.01NA0.010.01NA11NA0.130.00NA0.000.00NA0.000.00NA
gmx::ListOfLists<int>::pushBack(gmx::ArrayRef<int const>)libgromacs_mpi.so.70.01NA0.010.02NA0.021NA10.00NA0.000.00NA0.000.00NA0.00
constrained_atom_sigma2(float, atom_nonbonded_kinetic_prop_t const*, float*, float*)libgromacs_mpi.so.70.010.01NA0.010.03NA11NA2.251.96NA0.000.00NA0.000.00NA
dd_redistribute_cg(_IO_FILE*, long, gmx_domdec_t*, int*, t_state*, t_forcerec*, t_nrnb*, int*)libgromacs_mpi.so.70.01NA0.010.01NA0.021NA10.00NA0.000.00NA0.000.00NA0.00
dd_check_ftype(int, ReverseTopOptions const&)libgromacs_mpi.so.700.010.0100.020.02111NA0.130.000.000.000.000.000.000.00
float (anonymous namespace)::idihs<(BondedKernelFlavor)0>(int, int const*, t_iparams const*, float const (*) [3], float (*) [4], float (*) [3], t_pbc const*, float, float*, gmx::ArrayRef<float const>, t_fcdata*, t_disresdata*, t_oriresdata*, in...libgromacs_mpi.so.70.01NA0.010.01NA0.041NA15.13NA2.530.00NA0.000.00NA0.00
hack_digitlibc-2.28.so00.010.010.010.020.011110.000.000.000.000.000.000.000.000.00
fftwf_mkplan_hc2hclibfftw3f.so.3.5.50.010.01NA0.010.03NA11NA17.507.42NA0.000.00NA0.000.00NA
_INTERNAL719fd497::calc_cg_move(_IO_FILE*, long, gmx_domdec_t*, t_state*, int const*, float (*) [3], float const*, float const*, MoveLimits const&, int, int, gmx::ArrayRef<int>)libgromacs_mpi.so.7NA0.02NANA0.04NANA1NANA0.00NANA0.00NANA0.00NA
std::enable_if<((BondedKernelFlavor)0)==((BondedKernelFlavor)0), float>::type _INTERNAL72b35b0f::(anonymous namespace)::rbdihs<(BondedKernelFlavor)0>(int, int const*, t_iparams const*, float const (*) [3], float (*) [4], float (*) [3], t_pbc co...libgromacs_mpi.so.7NA0.02NANA0.07NANA1NANA22.09NANA0.00NANA0.00NA
atoms2md(gmx_mtop_t const&, t_inputrec const&, int, gmx::ArrayRef<int>, int, gmx::MDAtoms*) [clone .extracted]libgromacs_mpi.so.7NANA0.02NANA0.07NANA1NANA0.09NANA0.00NANA0.00
_INTERNALbed727ba::Nbnxm::sort_atoms(int, bool, int, bool, int*, int, gmx::ArrayRef<gmx::BasicVector<float> const>, float, float, int, gmx::ArrayRef<int>)libgromacs_mpi.so.7NA0.02NANA0.06NANA1NANA0.17NANA0.00NANA0.00NA
std::enable_if<(((BondedKernelFlavor)2)!=((BondedKernelFlavor)0))||(!(1)), float>::type _INTERNAL72b35b0f::(anonymous namespace)::rbdihs<(BondedKernelFlavor)2>(int, int const*, t_iparams const*, float const (*) [3], float (*) [4], float (*) [3]...libgromacs_mpi.so.7NA0.02NANA0.06NANA1NANA2.33NANA0.00NANA0.00NA
gmx_fft_many_1d(gmx_fft*, gmx_fft_direction, void*, void*)libgromacs_mpi.so.7NANA0.02NANA0.07NANA1NANA18.41NANA0.00NANA0.00
float _INTERNAL72b35b0f::(anonymous namespace)::idihs<(BondedKernelFlavor)0>(int, int const*, t_iparams const*, float const (*) [3], float (*) [4], float (*) [3], t_pbc const*, float, float*, gmx::ArrayRef<float const>, t_fcdata*, t_disresdata*...libgromacs_mpi.so.7NA0.02NANA0.07NANA1NANA2.43NANA0.00NANA0.00NA
gmx_fft_1d_real(gmx_fft*, gmx_fft_direction, void*, void*)libgromacs_mpi.so.7NANA0.02NANA0.05NANA1NANA34.30NANA0.00NANA0.00
fftwf_mkproblem_rdft_0_dlibfftw3f.so.3.5.50.010.01NA0.040.01NA11NA10.4149.88NA0.000.00NA0.000.00NA
std::enable_if<(((BondedKernelFlavor)2)!=((BondedKernelFlavor)0))||(!(1)), float>::type (anonymous namespace)::rbdihs<(BondedKernelFlavor)2>(int, int const*, t_iparams const*, float const (*) [3], float (*) [4], float (*) [3], t_pbc const*, flo...libgromacs_mpi.so.70.01NA0.010.03NA0.041NA11.54NA2.560.00NA0.000.00NA0.00
std::vector<int, std::allocator<int> >::_M_default_append(unsigned long)libgromacs_mpi.so.70.01NA0.010.03NA0.021NA10.00NA0.000.00NA0.000.00NA0.00
void do_dih_fup<(BondedKernelFlavor)0>(int, int, int, int, float, float*, float*, float*, float*, float*, float (*) [4], float (*) [3], t_pbc const*, float const (*) [3], int, int, int) [clone .isra.0]libgromacs_mpi.so.70.02NANA0.05NANA1NANA2.95NANA0.00NANA0.00NANA
Nbnxm::Grid::calcColumnIndices(Nbnxm::Grid::Dimensions const&, gmx::UpdateGroupsCog const*, gmx::Range<int>, gmx::ArrayRef<gmx::BasicVector<float> const>, int, int const*, int, int, gmx::ArrayRef<int>, gmx::ArrayRef<int>)libgromacs_mpi.so.70.02000.040.0101110.441.38NA0.000.000.000.000.000.00
atoms_to_constraints(gmx_domdec_t*, gmx_mtop_t const&, gmx::ArrayRef<long const>, gmx::ArrayRef<gmx::ListOfLists<int> const>, int, InteractionList*, std::vector<int, std::allocator<int> >*) [clone .isra.0]libgromacs_mpi.so.70.02NANA0.04NANA1NANA0.00NANA0.00NANA0.00NANA
Nbnxm::sort_atoms(int, bool, int, bool, int*, int, gmx::ArrayRef<gmx::BasicVector<float> const>, float, float, int, gmx::ArrayRef<int>) [clone .constprop.0] [clone .isra.0]libgromacs_mpi.so.70.02NANA0.06NANA1NANA0.13NANA0.00NANA0.00NANA
dd_make_local_constraints(gmx_domdec_t*, int, gmx_mtop_t const&, gmx::ArrayRef<long const>, gmx::Constraints*, int, gmx::ArrayRef<InteractionList>) [clone ._omp_fn.0]libgromacs_mpi.so.70.02NANA0.06NANA1NANA0.00NANA0.00NANA0.00NANA
unwrap_periodic_pmegrid(gmx_pme_t*, float*) [clone ._omp_fn.1]libgromacs_mpi.so.70.02NANA0.06NANA1NANA0.00NANA0.00NANA0.00NANA
Nbnxm::sort_atoms(int, bool, int, bool, int*, int, gmx::ArrayRef<gmx::BasicVector<float> const>, float, float, int, gmx::ArrayRef<int>)libgromacs_mpi.so.7NANA0.02NANA0.07NANA1NANA0.18NANA0.00NANA0.00
fftwf_rdft2_solvelibfftw3f.so.3.5.50.010.01NA0.030.04NA11NA13.638.09NA0.000.00NA0.000.00NA
sum_forces(gmx::ArrayRef<gmx::BasicVector<float> >, gmx::ArrayRef<gmx::BasicVector<float> const>) [clone ._omp_fn.0]libgromacs_mpi.so.70.02NANA0.05NANA1NANA2.83NANA0.00NANA0.00NANA
_INTERNAL719fd497::copyMovedAtomsToBufferPerAtom(gmx::ArrayRef<int const>, int, int, float (*) [3], gmx_domdec_comm_t*)libgromacs_mpi.so.7NA0.01NANA0.01NANA1NANA0.00NANA0.00NANA0.00NA
Unknown function[vdso]0.010NA0.020NA11NA0.94NANA0.000.00NA0.000.00NA
__mpn_mul_1libc-2.28.so0.01000.020.0101110.000.00NA0.000.000.000.000.000.00
make_dp_periodic(float*)libgromacs_mpi.so.700.01NA00.01NA11NANA5.50NA0.000.00NA0.000.00NA
__libm_exp_k32libgromacs_mpi.so.7NA0.01NANA0.01NANA1NANA4.63NANA0.00NANA0.00NA
clearDDStateIndices(gmx_domdec_t*, bool)libgromacs_mpi.so.70.01NANA0.02NANA1NANA0.00NANA0.00NANA0.00NANA
gmx_reverse_top_t::hasPositionRestraints() constlibgromacs_mpi.so.700.01000.010111NA0.00NA0.000.000.000.000.000.00
void _INTERNAL86d71067::orderVector<int>(gmx::ArrayRef<gmx_cgsort const>, gmx::ArrayRef<int>, gmx::ArrayRef<int>)libgromacs_mpi.so.7NA0.01NANA0.01NANA1NANA0.00NANA0.00NANA0.00NA
gmx::InMemoryDeserializer::doFloat(float*)libgromacs_mpi.so.7NA00.01NA00.01NA11NANA0.00NA0.000.00NA0.000.00
_INTERNAL86d71067::dd_sort_order_nbnxn(t_forcerec const*, std::vector<gmx_cgsort, std::allocator<gmx_cgsort> >*)libgromacs_mpi.so.7NA0.01NANA0.01NANA1NANA0.00NANA0.00NANA0.00NA
_IO_fwritelibc-2.28.soNA00.01NA0.010.02NA11NA0.000.00NA0.000.00NA0.000.00
do_stopcm_grp(t_mdatoms const&, gmx::ArrayRef<gmx::BasicVector<float> >, gmx::ArrayRef<gmx::BasicVector<float> >, t_vcm const&) [clone ._omp_fn.0]libgromacs_mpi.so.70.01NANA0.01NANA1NANA0.50NANA0.00NANA0.00NANA
L__Z31nbnxn_atomdata_copy_x_to_nbat_xRKN5Nbnxm7GridSetEN3gmx12AtomLocalityEPA3_KfP16nbnxn_atomdata_t_993__par_region0_2_54libgromacs_mpi.so.7NA0.01NANA0.01NANA1NANA0.00NANA0.00NANA0.00NA
_INTERNAL86d71067::make_dd_indices(gmx_domdec_t*, int)libgromacs_mpi.so.7NA0.01NANA0.02NANA1NANA0.00NANA0.00NANA0.00NA
void get_cell_range<0>(float, float, Nbnxm::Grid::Dimensions const&, float, float, int*, int*)libgromacs_mpi.so.70.01NANA0.02NANA1NANA11.00NANA0.00NANA0.00NANA
_INTERNALbed727ba::Nbnxm::sort_cluster_on_flag(int, int, int, gmx::ArrayRef<long const>, gmx::ArrayRef<int>, int*)libgromacs_mpi.so.7NA0.01NANA0.04NANA1NANA0.00NANA0.00NANA0.00NA
gmx::SettleData::ow1() constlibgromacs_mpi.so.7NA0.01NANA0.02NANA1NANA15.00NANA0.00NANA0.00NA
void _INTERNALb629d8fd::get_cell_range<1>(float, float, Nbnxm::Grid::Dimensions const&, float, float, int*, int*)libgromacs_mpi.so.7NA0.01NANA0.03NANA1NANA12.79NANA0.00NANA0.00NA
void std::vector<int, std::allocator<int> >::_M_range_insert<gmx::ArrayRefIter<int const> >(__gnu_cxx::__normal_iterator<int*, std::vector<int, std::allocator<int> > >, gmx::ArrayRefIter<int const>, gmx::Arra...libgromacs_mpi.so.7NA0.01NANA0.02NANA1NANA0.00NANA0.00NANA0.00NA
gmx::SettleData::hw2() constlibgromacs_mpi.so.7NA0.01NANA0.02NANA1NANA16.00NANA0.00NANA0.00NA
_INTERNALb629d8fd::makeClusterListWrapper(NbnxnPairlistCpu*, Nbnxm::Grid const&, int, Nbnxm::Grid const&, int, int, bool, nbnxn_atomdata_t const*, float, float, ClusterDistanceKernelType, int*)libgromacs_mpi.so.7NA0.01NANA0.02NANA1NANA8.88NANA0.00NANA0.00NA
void _INTERNALb629d8fd::get_cell_range<0>(float, float, Nbnxm::Grid::Dimensions const&, float, float, int*, int*)libgromacs_mpi.so.7NA0.01NANA0.04NANA1NANA7.41NANA0.00NANA0.00NA
void _INTERNAL86d71067::orderVector<gmx::BasicVector<float> >(gmx::ArrayRef<gmx_cgsort const>, gmx::ArrayRef<gmx::BasicVector<float> >, gmx::ArrayRef<gmx::BasicVector<float> >)libgromacs_mpi.so.7NA0.01NANA0.02NANA1NANA0.00NANA0.00NANA0.00NA
void _INTERNAL86d71067::orderVector<long>(gmx::ArrayRef<gmx_cgsort const>, gmx::ArrayRef<long>, gmx::ArrayRef<long>)libgromacs_mpi.so.7NA0.01NANA0.02NANA1NANA0.00NANA0.00NANA0.00NA
_INTERNAL14e05f89::postProcessForces(t_commrec const*, long, t_nrnb*, gmx_wallcycle*, float const (*) [3], gmx::ArrayRef<gmx::BasicVector<float> const>, gmx::ForceOutputs*, float (*) [3], t_mdatoms const*, t_forcerec const*, gmx::VirtualSitesHa...libgromacs_mpi.so.7NA0.01NANA0.04NANA1NANA2.22NANA0.00NANA0.00NA
setup_bonded_threading(bonded_threading_t*, int, bool, InteractionDefinitions const&)libgromacs_mpi.so.7NA0.01NANA0.03NANA1NANA0.00NANA0.00NANA0.00NA
_intel_fast_memcpygmx_mpiNA00.01NA00.01NA11NANA0.25NA0.000.00NA0.000.00
_INTERNALb629d8fd::icell_set_x(int, float, float, float, int, float const*, ClusterDistanceKernelType, NbnxnPairlistCpuWork*)libgromacs_mpi.so.7NA0.01NANA0.02NANA1NANA3.25NANA0.00NANA0.00NA
_INTERNAL661916bb::gmx::set_lincs_matrix_task(_INTERNAL661916bb::gmx::Lincs*, _INTERNAL661916bb::gmx::Task*, _INTERNAL661916bb::gmx::ArrayRef<float const>, int*, int*)libgromacs_mpi.so.7NA0.01NANA0.02NANA1NANA0.63NANA0.00NANA0.00NA
_INTERNALd64f4cfb::atomInMolblockFromGlobalAtomnr(gmx::ArrayRef<MolblockIndices const>, int)libgromacs_mpi.so.7NA0.01NANA0.03NANA1NANA0.00NANA0.00NANA0.00NA
dd_bonded_cg_distance(gmx::MDLogger const&, gmx_mtop_t const&, t_inputrec const&, gmx::ArrayRef<gmx::BasicVector<float> const>, float const (*) [3], gmx::DDBondedChecking, float*, float*)libgromacs_mpi.so.70.01NA00.01NA0.011NA11.63NA1.750.00NA0.000.00NA0.00
gmx::makeAtomsToConstraintsList(int, gmx::ArrayRef<InteractionList const>, gmx::ArrayRef<t_iparams const>, gmx::FlexibleConstraintTreatment)libgromacs_mpi.so.7NANA0.01NANA0.02NANA1NANA0.00NANA0.00NANA0.00
gmx::set_lincs(InteractionDefinitions const&, int, gmx::ArrayRef<float const>, float, bool, t_commrec const*, gmx::Lincs*) [clone .extracted]libgromacs_mpi.so.7NANA0.01NANA0.02NANA1NANA0.00NANA0.00NANA0.00
fftwf_isqrtlibfftw3f.so.3.5.500.01NA00.02NA11NANA0.00NA0.000.00NA0.000.00NA
dd_redistribute_cg(_IO_FILE*, long, gmx_domdec_t*, int*, t_state*, t_forcerec*, t_nrnb*, int*) [clone .extracted]libgromacs_mpi.so.7NANA0.01NANA0.02NANA1NANA0.00NANA0.00NANA0.00
fftwf_cpy2d_pairlibfftw3f.so.3.5.500.01NA00.02NA11NANA1.56NA0.000.00NA0.000.00NA
gmx_reverse_top_t::molblockIndices() constlibgromacs_mpi.so.7NANA0.01NANA0.01NANA1NANA0.00NANA0.00NANA0.00
mkl_dft_avx2_ownscDftInv_PrimeFact_32fc@pltlibmkl_avx2.so.2NANA0.01NANA0.01NANA1NANA13.38NANA0.00NANA0.00
__libm_exp_k32gmx_mpiNANA0.01NANA0.02NANA1NANA1.88NANA0.00NANA0.00
void do_dih_fup<(BondedKernelFlavor)0>(int, int, int, int, float, float*, float*, float*, float*, float*, float (*) [4], float (*) [3], t_pbc const*, float const (*) [3], int, int, int)libgromacs_mpi.so.7NANA0.01NANA0.03NANA1NANA4.21NANA0.00NANA0.00
make_dd_indices(gmx_domdec_t*, int)libgromacs_mpi.so.70.01NA00.01NA01NA10.00NANA0.00NA0.000.00NA0.00
gmx_fft_many_1d_real(gmx_fft*, gmx_fft_direction, void*, void*)libgromacs_mpi.so.7NANA0.01NANA0.04NANA1NANA16.69NANA0.00NANA0.00
sum_forces(gmx::ArrayRef<gmx::BasicVector<float> >, gmx::ArrayRef<gmx::BasicVector<float> const>) [clone .extracted]libgromacs_mpi.so.7NANA0.01NANA0.03NANA1NANA4.75NANA0.00NANA0.00
int make_bondeds_zone<true>(gmx_reverse_top_t const&, gmx::ArrayRef<int const>, gmx_ga2la_t const&, gmx_domdec_zones_t const&, std::vector<gmx_molblock_t, std::allocator<gmx_molblock_t> > const&, bool, int const*, bo...libgromacs_mpi.so.7NANA0.01NANA0.04NANA1NANA0.00NANA0.00NANA0.00
atoms_to_constraints(gmx_domdec_t*, gmx_mtop_t const&, gmx::ArrayRef<long const>, gmx::ArrayRef<gmx::ListOfLists<int> const>, int, InteractionList*, std::vector<int, std::allocator<int> >*)libgromacs_mpi.so.7NANA0.01NANA0.04NANA1NANA0.00NANA0.00NANA0.00
unwrap_periodic_pmegrid(gmx_pme_t*, float*) [clone .extracted.31]libgromacs_mpi.so.7NANA0.01NANA0.04NANA1NANA0.00NANA0.00NANA0.00
gmx::set_lincs_matrix(gmx::Lincs*, gmx::ArrayRef<float const>, float) [clone ._omp_fn.0]libgromacs_mpi.so.70.01NANA0.02NANA1NANA0.38NANA0.00NANA0.00NANA
setup_bonded_threading(bonded_threading_t*, int, bool, InteractionDefinitions const&) [clone .extracted]libgromacs_mpi.so.7NANA0.01NANA0.02NANA1NANA0.00NANA0.00NANA0.00
mk_mshift(_IO_FILE*, t_graph*, PbcType, float const (*) [3], float const (*) [3])libgromacs_mpi.so.70.01000.0200.011110.88NA2.380.000.000.000.000.000.00
__GI___explibm-2.28.so0.01NANA0.01NANA1NANA10.13NANA0.00NANA0.00NANA
unwrap_periodic_pmegrid(gmx_pme_t*, float*) [clone ._omp_fn.0]libgromacs_mpi.so.70.01NANA0.03NANA1NANA0.00NANA0.00NANA0.00NANA
gmx::set_lincs(InteractionDefinitions const&, int, gmx::ArrayRef<float const>, float, bool, t_commrec const*, gmx::Lincs*)libgromacs_mpi.so.700.01NA00.01NA11NANA0.00NA0.000.00NA0.000.00NA
__acosflibm-2.28.so0.01NANA0.01NANA1NANA2.75NANA0.00NANA0.00NANA
fftwf_codelet_n1_2libfftw3f.so.3.5.500.01NA0.010.01NA11NA1.381.13NA0.000.00NA0.000.00NA
dd_redistribute_cg(_IO_FILE*, long, gmx_domdec_t*, int*, t_state*, t_forcerec*, t_nrnb*, int*) [clone ._omp_fn.0]libgromacs_mpi.so.70.01NANA0.03NANA1NANA0.00NANA0.00NANA0.00NANA
_INTERNALcd96ede4::atoms_to_constraints(gmx_domdec_t*, gmx_mtop_t const&, gmx::ArrayRef<long const>, gmx::ArrayRef<gmx::ListOfLists<int> const>, int, InteractionList*, std::vector<int, std::allocator<int> >*)libgromacs_mpi.so.7NA0.01NANA0.04NANA1NANA0.00NANA0.00NANA0.00NA
__memcpy_avx_unalignedlibc-2.28.so0.010NA0.010NA11NA8.75NANA0.000.00NA0.000.00NA
do_lookup_xld-2.28.so0.01000.03001110.00NANA0.000.000.000.000.000.00
getVerletBufferAtomtypes(gmx_mtop_t const&, bool, bool)libgromacs_mpi.so.70.01NA00.03NA0.011NA10.00NA0.000.00NA0.000.00NA0.00
nbnxn_atomdata_set(nbnxn_atomdata_t*, Nbnxm::GridSet const&, gmx::ArrayRef<int const>, gmx::ArrayRef<float const>, gmx::ArrayRef<long const>)libgromacs_mpi.so.70NA0.010.01NA0.021NA10.00NA0.000.00NA0.000.00NA0.00
gmx::set_lincs(InteractionDefinitions const&, int, gmx::ArrayRef<float const>, float, bool, t_commrec const*, gmx::Lincs*) [clone ._omp_fn.0]libgromacs_mpi.so.70.01NANA0.03NANA1NANA0.00NANA0.00NANA0.00NANA
setup_bonded_threading(bonded_threading_t*, int, bool, InteractionDefinitions const&) [clone ._omp_fn.0]libgromacs_mpi.so.70.01NANA0.03NANA1NANA0.00NANA0.00NANA0.00NANA
void get_cell_range<1>(float, float, Nbnxm::Grid::Dimensions const&, float, float, int*, int*)libgromacs_mpi.so.70.01NANA0.03NANA1NANA9.46NANA0.00NANA0.00NANA
gmx::ArrayRef<float> gmx::arrayRefFromArray<float>(float*, unsigned long)libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
wallcycle_stop(gmx_wallcycle*, WallCycleCounter)libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
int _INTERNALd64f4cfb::make_bondeds_zone<true>(gmx_reverse_top_t const&, gmx::ArrayRef<int const>, gmx_ga2la_t const&, gmx_domdec_zones_t const&, std::vector<gmx_molblock_t, std::allocator<gmx_molblock_t> > const&, b...libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
__kmp_invoke_microtasklibiomp5.soNA0NANA0NANA1NANANANANA0.00NANA0.00NA
gmx_gettime()libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
_INTERNAL7a068aa4::gmx::constr_recur(_INTERNAL7a068aa4::gmx::ListOfLists<int> const&, std::array<InteractionList, 94ul> const&, _INTERNAL7a068aa4::gmx::ArrayRef<t_iparams const>, bool, int, int, int, _INTERNAL7a068aa4::gmx::ArrayR...libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
_INTERNAL25d1f74a::computeAtomGroupDomainIndex(gmx_domdec_t const&, gmx_ddbox_t const&, float const (&) [3][3], gmx::ArrayRef<std::vector<float, std::allocator<float> > const>, int, int, float const (*) [3], float (*) [3])libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
getGroupType(SimulationGroups const&, SimulationAtomGroupType, int)libgromacs_mpi.so.7NA00NA00.01NA11NANA0.00NA0.000.00NA0.000.00
_INTERNALcfff3329::getVerletBufferAtomtypes(gmx_mtop_t const&, bool, bool)libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
_INTERNALb629d8fd::set_icell_bb_simple(gmx::ArrayRef<Nbnxm::BoundingBox const>, int, float, float, float, Nbnxm::BoundingBox*)libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
_INTERNALfb13a680::bonded_cg_distance_mol(gmx_moltype_t const*, gmx::DDBondedChecking, bool, gmx::ArrayRef<gmx::BasicVector<float> const>, bonded_distance_t*, bonded_distance_t*)libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
nbnxn_atomdata_copy_shiftvec(bool, gmx::ArrayRef<gmx::BasicVector<float> >, nbnxn_atomdata_t*)libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
gmx_omp_nthreads_get(ModuleMultiThread)libgromacs_mpi.so.7NA00NA00NA11NANANANA0.000.00NA0.000.00
_INTERNAL95fec573::nbnxn_atomdata_set_charges(nbnxn_atomdata_t*, Nbnxm::GridSet const&, gmx::ArrayRef<float const>)libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
_INTERNALfb13a680::getWholeMoleculeCoordinates(gmx_moltype_t const*, gmx_ffparams_t const*, PbcType, t_graph*, float const (*) [3], gmx::ArrayRef<gmx::BasicVector<float> const>, gmx::ArrayRef<gmx::BasicVector<float> >)libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
nbnxn_atomdata_t::resizeCoordinateBuffer(int)libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
_INTERNALb629d8fd::next_ci(Nbnxm::Grid const&, int, int, int*, int*, int*, int*)libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
_INTERNALce49b591::nbnxn_kernel_cpu(PairlistSet const&, Nbnxm::KernelSetup const&, nbnxn_atomdata_t*, interaction_const_t const&, gmx::ArrayRef<gmx::BasicVector<float> const>, gmx::StepWorkload const&, int, float*, float*, gmx_w...libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
_INTERNAL2ceaac6b::dd_collect_vec_sendrecv(gmx_domdec_t*, gmx::ArrayRef<gmx::BasicVector<float> const>, gmx::ArrayRef<gmx::BasicVector<float> >)libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
_INTERNAL661916bb::gmx::makeLincsDeviations(_INTERNAL661916bb::gmx::Lincs const&, _INTERNAL661916bb::gmx::ArrayRef<_INTERNAL661916bb::gmx::BasicVector<float> const>, t_pbc const*)libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
_INTERNALaeba2741::mk_grey(gmx::ArrayRef<egCol>, t_graph*, int*, int, float const (*) [3], float const (*) [3], int*)libgromacs_mpi.so.7NA0NANA0.01NANA1NANA1.00NANA0.00NANA0.00NA
_INTERNAL661916bb::gmx::assign_constraint(_INTERNAL661916bb::gmx::Lincs*, int, int, int, float, float, _INTERNAL661916bb::gmx::ListOfLists<int> const&)libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
gmx::SettleData::virfac() constlibgromacs_mpi.so.7NA0NANA0.01NANA1NANA4.13NANA0.00NANA0.00NA
_INTERNAL661916bb::gmx::set_matrix_indices(_INTERNAL661916bb::gmx::Lincs*, _INTERNAL661916bb::gmx::Task const&, _INTERNAL661916bb::gmx::ListOfLists<int> const&, bool)libgromacs_mpi.so.7NA0NANA0.01NANA1NANA0.00NANA0.00NANA0.00NA
gmx::make_at2con(int, gmx::ArrayRef<InteractionList const>, gmx::ArrayRef<t_iparams const>, gmx::FlexibleConstraintTreatment)libgromacs_mpi.so.7NA0NANA0.01NANA1NANA0.00NANA0.00NANA0.00NA
_INTERNAL719fd497::clear_and_mark_ind(gmx::ArrayRef<int const>, gmx::ArrayRef<int const>, gmx_ga2la_t*, int*)libgromacs_mpi.so.7NA0NANA0.01NANA1NANA0.00NANA0.00NANA0.00NA
gmx::SettleData::hw3() constlibgromacs_mpi.so.7NA0NANA0.01NANA1NANA33.00NANA0.00NANA0.00NA
atan2flibgromacs_mpi.so.7NA0NANA0.01NANA1NANA3.63NANA0.00NANA0.00NA
ewald_charge_correction(t_commrec const*, float, float, gmx::ArrayRef<double const>, float, float const (*) [3], float*, float (*) [3])libgromacs_mpi.so.7NA00NA0.010NA11NA0.00NANA0.000.00NA0.000.00
__kmpc_end_masterlibiomp5.soNA0NANA0NANA1NANANANANA0.00NANA0.00NA
_INTERNAL661916bb::gmx::set_lincs_matrix(_INTERNAL661916bb::gmx::Lincs*, _INTERNAL661916bb::gmx::ArrayRef<float const>, float)libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
_INTERNAL86d71067::clearDDStateIndices(gmx_domdec_t*, bool)libgromacs_mpi.so.7NA0NANA0.01NANA1NANA0.00NANA0.00NANA0.00NA
__intel_avx_memmovegmx_mpiNA0NANA0.01NANA1NANA0.00NANA0.00NANA0.00NA
calc_vcm_grp(t_mdatoms const&, gmx::ArrayRef<gmx::BasicVector<float> const>, gmx::ArrayRef<gmx::BasicVector<float> const>, t_vcm*)libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
gmx::makeMDAtoms(_IO_FILE*, gmx_mtop_t const&, t_inputrec const&, bool)libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
_INTERNAL7742301e::calc_ke_part_normal(gmx::ArrayRef<gmx::BasicVector<float> const>, t_grpopts const*, t_mdatoms const*, gmx_ekindata_t*, t_nrnb*, bool)libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
_INTERNAL95fec573::nbnxn_atomdata_set_atomtypes(nbnxn_atomdata_t::Params*, Nbnxm::GridSet const&, gmx::ArrayRef<int const>)libgromacs_mpi.so.7NA0NANA0.01NANA1NANA0.00NANA0.00NANA0.00NA
float _INTERNAL72b35b0f::(anonymous namespace)::idihs<(BondedKernelFlavor)2>(int, int const*, t_iparams const*, float const (*) [3], float (*) [4], float (*) [3], t_pbc const*, float, float*, gmx::ArrayRef<float const>, t_fcdata*, t_disresdata*...libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
erfcflibgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
_INTERNAL115a3b1f::calcBondedForces(InteractionDefinitions const&, bonded_threading_t*, float const (*) [3], t_forcerec const*, t_pbc const*, float (*) [3], gmx_enerdata_t*, t_nrnb*, gmx::ArrayRef<float const>, gmx::ArrayRef<float>, t_mdato...libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
fftwf_ct_applicablelibfftw3f.so.3.5.5NA0NANA0.01NANA1NANA0.38NANA0.00NANA0.00NA
__kmpc_fork_calllibiomp5.soNA00NA00NA11NANANANA0.000.00NA0.000.00
__kmp_enter_singlelibiomp5.soNA0NANA0NANA1NANANANANA0.00NANA0.00NA
fftwf_codelet_q1bv_8_avxlibfftw3f.so.3.5.5NA0NANA0NANA1NANANANANA0.00NANA0.00NA
gmx_parallel_3dfft_complex_limits(gmx_parallel_3dfft*, int*, int*, int*, int*)libgromacs_mpi.so.7NANA0NANA0NANA1NANANANANA0.00NANA0.00
gmx_pme_do(gmx_pme_t*, gmx::ArrayRef<gmx::BasicVector<float> const>, gmx::ArrayRef<gmx::BasicVector<float> >, gmx::ArrayRef<float const>, gmx::ArrayRef<float const>, gmx::ArrayRef<float const>, gmx::ArrayRef<flo...libgromacs_mpi.so.7NANA0NANA0NANA1NANANANANA0.00NANA0.00
gmx::HostAllocationPolicy::HostAllocationPolicy(gmx::PinningPolicy)libgromacs_mpi.so.7NANA0NANA0NANA1NANANANANA0.00NANA0.00
mkl_dft_avx2_ownscDftInv_Fact3_32fc@pltlibmkl_avx2.so.2NANA0NANA0.01NANA1NANA5.00NANA0.00NANA0.00
mkl_dft_avx2_transfer_ipp_mkl_errorlibmkl_avx2.so.2NANA0NANA0NANA1NANANANANA0.00NANA0.00
nbnxn_atomdata_copy_x_to_nbat_x(Nbnxm::GridSet const&, gmx::AtomLocality, float const (*) [3], nbnxn_atomdata_t*) [clone .extracted]libgromacs_mpi.so.7NANA0NANA0.01NANA1NANA0.00NANA0.00NANA0.00
calc_vcm_grp(t_mdatoms const&, gmx::ArrayRef<gmx::BasicVector<float> const>, gmx::ArrayRef<gmx::BasicVector<float> const>, t_vcm*) [clone .extracted]libgromacs_mpi.so.7NANA0NANA0NANA1NANANANANA0.00NANA0.00
gmx::Update::deform() constlibgromacs_mpi.so.7NANA0NANA0NANA1NANANANANA0.00NANA0.00
__strnlen_avx2libc-2.28.soNANA0NANA0NANA1NANANANANA0.00NANA0.00
gmx::Update::update_sd_second_half(t_inputrec const&, long, float*, int, gmx::ArrayRef<ParticleType const>, gmx::ArrayRef<float const>, t_state*, t_commrec const*, t_nrnb*, gmx_wallcycle*, gmx::Constraints*, bool, bool)libgromacs_mpi.so.7NANA0NANA0NANA1NANANANANA0.00NANA0.00
update_pcouple_after_coordinates(_IO_FILE*, long, t_inputrec const*, int, gmx::ArrayRef<unsigned short const>, float const (*) [3], float const (*) [3], float const (*) [3], float (*) [3], t_state*, t_nrnb*, gmx::BoxDeformation*, bool)libgromacs_mpi.so.7NANA0NANA0NANA1NANANANANA0.00NANA0.00
reset_enerdata(gmx_enerdata_t*)libgromacs_mpi.so.7NANA0NANA0NANA1NANANANANA0.00NANA0.00
__GI__dl_addrlibc-2.28.soNANA0NANA0NANA1NANANANANA0.00NANA0.00
gmx::set_lincs_matrix(gmx::Lincs*, gmx::ArrayRef<float const>, float) [clone .extracted]libgromacs_mpi.so.7NANA0NANA0.01NANA1NANA1.13NANA0.00NANA0.00
mkl_dft_avx2_ownscDftFwd_Fact4_32fc@pltlibmkl_avx2.so.2NANA0NANA0NANA1NANANANANA0.00NANA0.00
cosgmx_mpiNANA0NANA0NANA1NANANANANA0.00NANA0.00
expgmx_mpiNANA0NANA0NANA1NANANANANA0.00NANA0.00
atan2fgmx_mpiNANA0NANA0NANA1NANANANANA0.00NANA0.00
fftwf_cpy2d_cilibfftw3f.so.3.5.5NA0NANA0NANA1NANANANANA0.00NANA0.00NA
fftwf_cpy2d_pair_cilibfftw3f.so.3.5.5NA0NANA0NANA1NANANANANA0.00NANA0.00NA
mkl_dft_avx2_owns_cCcsRecombine_32f@pltlibmkl_avx2.so.2NANA0NANA0NANA1NANANANANA0.00NANA0.00
logfgmx_mpiNANA0NANA0NANA1NANANANANA0.00NANA0.00
__libm_cos_l9gmx_mpiNANA0NANA0NANA1NANANANANA0.00NANA0.00
mkl_dft_avx2_ippsFFTFwd_RToPerm_32f@pltlibmkl_avx2.so.2NANA0NANA0NANA1NANANANANA0.00NANA0.00
pthread_selflibpthread-2.28.soNANA0NANA0NANA1NANANANANA0.00NANA0.00
mkl_dft_avx2_ownscDftFwd_Prime8_32fc@pltlibmkl_avx2.so.2NANA0NANA0NANA1NANANANANA0.00NANA0.00
mkl_dft_avx2_ippsFFTInv_CCSToR_32f@pltlibmkl_avx2.so.2NANA0NANA0NANA1NANANANANA0.00NANA0.00
fftwf_codelet_t2_25libfftw3f.so.3.5.5NA0NANA0NANA1NANANANANA0.00NANA0.00NA
mkl_dft_avx2_ownscDftFwd_PrimeFact_32fc@pltlibmkl_avx2.so.2NANA0NANA0NANA1NANANANANA0.00NANA0.00
computeAtomGroupDomainIndex(gmx_domdec_t const&, gmx_ddbox_t const&, float const (&) [3][3], gmx::ArrayRef<std::vector<float, std::allocator<float> > const>, int, int, float const (*) [3], float (*) [3])libgromacs_mpi.so.7NANA0NANA0NANA1NANANANANA0.00NANA0.00
mkl_serv_verbose_mode@pltlibmkl_intel_lp64.so.2NANA0NANA0NANA1NANANANANA0.00NANA0.00
.plt.got@startlibmkl_avx2.so.2NANA0NANA0NANA1NANANANANA0.00NANA0.00
gmx::Constraints::Impl::apply(bool, bool, long, int, float, gmx::ArrayRefWithPadding<gmx::BasicVector<float> >, gmx::ArrayRefWithPadding<gmx::BasicVector<float> >, gmx::ArrayRef<gmx::BasicVector<float> >, float const (*)...libgromacs_mpi.so.7NANA0NANA0NANA1NANANANANA0.00NANA0.00
postProcessForces(t_commrec const*, long, t_nrnb*, gmx_wallcycle*, float const (*) [3], gmx::ArrayRef<gmx::BasicVector<float> const>, gmx::ForceOutputs*, float (*) [3], t_mdatoms const*, t_forcerec const*, gmx::VirtualSitesHandler*, gmx::StepWo...libgromacs_mpi.so.7NANA0NANA0NANA1NANANANANA0.00NANA0.00
gmx::makeLincsDeviations(gmx::Lincs const&, gmx::ArrayRef<gmx::BasicVector<float> const>, t_pbc const*)libgromacs_mpi.so.7NANA0NANA0NANA1NANANANANA0.00NANA0.00
gmx::SimulationSignaller::getCommunicationBuffer()libgromacs_mpi.so.7NANA0NANA0NANA1NANANANANA0.00NANA0.00
mkl_dft_avx2_owns_cRealRecombine_32f@pltlibmkl_avx2.so.2NANA0NANA0NANA1NANANANANA0.00NANA0.00
make_tables(_IO_FILE*, interaction_const_t const*, char const*, float, int)libgromacs_mpi.so.7NANA0NANA0NANA1NANANANANA0.00NANA0.00
__kmpc_push_num_threadslibiomp5.soNANA0NANA0NANA1NANANANANA0.00NANA0.00
mkl_dft_avx2_ownscDftInv_Fact4_32fc@pltlibmkl_avx2.so.2NANA0NANA0NANA1NANANANANA0.00NANA0.00
mkl_dft_avx2_ownscDftFwd_Fact3_32fc@pltlibmkl_avx2.so.2NANA0NANA0NANA1NANANANANA0.00NANA0.00
low_set_pbc(t_pbc*, PbcType, int const*, float const (*) [3])libgromacs_mpi.so.7NANA0NANA0NANA1NANANANANA0.00NANA0.00
dd_move_x_specat(gmx_domdec_t const*, gmx_domdec_specat_comm_t*, float const (*) [3], float (*) [3], float (*) [3], bool)libgromacs_mpi.so.7NANA0NANA0NANA1NANANANANA0.00NANA0.00
void doStopComMotionLinear<3>(t_mdatoms const&, gmx::ArrayRef<gmx::BasicVector<float> >, t_vcm const&)libgromacs_mpi.so.7NANA0NANA0NANA1NANANANANA0.00NANA0.00
calcBondedForces(InteractionDefinitions const&, bonded_threading_t*, float const (*) [3], t_forcerec const*, t_pbc const*, float (*) [3], gmx_enerdata_t*, t_nrnb*, gmx::ArrayRef<float const>, gmx::ArrayRef<float>, t_mdatoms const*, t_fcdata...libgromacs_mpi.so.7NANA0NANA0NANA1NANANANANA0.00NANA0.00
_IO_vfscanflibc-2.28.soNANA0NANA0NANA1NANANANANA0.00NANA0.00
__libm_logf_l9gmx_mpiNANA0NANA0NANA1NANANANANA0.00NANA0.00
_IO_padnlibc-2.28.soNANA0NANA0NANA1NANANANANA0.00NANA0.00
__kmp_barrierlibiomp5.soNANA0NANA0NANA1NANANANANA0.00NANA0.00
(anonymous namespace)::calc_one_bond(int, int, InteractionDefinitions const&, gmx::ArrayRef<int const>, int, WorkDivision const&, float const (*) [3], float (*) [4], float (*) [3], t_forcerec const*, t_pbc const*, gmx_grppairener_t*, t_nrnb*,...libgromacs_mpi.so.7NANA0NANA0NANA1NANANANANA0.00NANA0.00
__libm_erf_exgmx_mpiNANA0NANA0NANA1NANANANANA0.00NANA0.00
expfgmx_mpiNANA0NANA0NANA1NANANANANA0.00NANA0.00
gmx_pme_do(gmx_pme_t*, gmx::ArrayRef<gmx::BasicVector<float> const>, gmx::ArrayRef<gmx::BasicVector<float> >, gmx::ArrayRef<float const>, gmx::ArrayRef<float const>, gmx::ArrayRef<float const>, gmx::ArrayRef<flo...libgromacs_mpi.so.7NANA0NANA0NANA1NANANANANA0.00NANA0.00
sincosfgmx_mpiNANA0NANA0NANA1NANANANANA0.00NANA0.00
_dl_lookup_symbol_xld-2.28.soNANA0NANA0NANA1NANANANANA0.00NANA0.00
erfcfgmx_mpiNANA0NANA0NANA1NANANANANA0.00NANA0.00
__kmpc_global_thread_numlibiomp5.soNA0NANA0NANA1NANANANANA0.00NANA0.00NA
_intel_fast_memsetgmx_mpiNA00NA00NA11NANANANA0.000.00NA0.000.00
fftwf_codelet_hc2cfdft_2libfftw3f.so.3.5.5NA0NANA0NANA1NANANANANA0.00NANA0.00NA
void _INTERNALa35aedc8::gmx::settleTemplate<_INTERNALa35aedc8::gmx::SimdFloat, _INTERNALa35aedc8::gmx::SimdFBool, 8, float const*, false, false>(_INTERNALa35aedc8::gmx::SettleData const&, int, int, float const*, float const*, float*, float, float...libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
gmx::csettle(gmx::SettleData const&, int, int, t_pbc const*, gmx::ArrayRefWithPadding<gmx::BasicVector<float> const>, gmx::ArrayRefWithPadding<gmx::BasicVector<float> >, float, gmx::ArrayRefWithPadding<gmx::BasicVector<flo...libgromacs_mpi.so.7NA00NA00NA11NANANANA0.000.00NA0.000.00
void _INTERNAL30ba3db8::doStopComMotionLinear<3>(t_mdatoms const&, gmx::ArrayRef<gmx::BasicVector<float> >, t_vcm const&)libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
_INTERNAL115a3b1f::(anonymous namespace)::calc_one_bond(int, int, InteractionDefinitions const&, gmx::ArrayRef<int const>, int, WorkDivision const&, float const (*) [3], float (*) [4], float (*) [3], t_forcerec const*, t_pbc const*, gmx_grppa...libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
_INTERNAL115a3b1f::(anonymous namespace)::calc_listed(gmx_wallcycle*, InteractionDefinitions const&, bonded_threading_t*, float const (*) [3], gmx::ForceOutputs*, t_forcerec const*, t_pbc const*, gmx_enerdata_t*, t_nrnb*, gmx::ArrayRef<float const&g...libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
L__Z10gmx_pme_doP9gmx_pme_tN3gmx8ArrayRefIKNS1_11BasicVectorIfEEEENS2_IS4_EENS2_IKfEES9_S9_S9_S9_S9_PA3_S8_PK9t_commreciiP6t_nrnbP13gmx_wallcyclePA3_fSK_PfSL_ffSL_SL_RKNS1_12StepWorkloadE_1401__par_region1_2_104libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
_INTERNAL661916bb::gmx::lincs_update_atoms(_INTERNAL661916bb::gmx::Lincs*, int, float, _INTERNAL661916bb::gmx::ArrayRef<float const>, _INTERNAL661916bb::gmx::ArrayRef<_INTERNAL661916bb::gmx::BasicVector<float> const>, _INTERNAL661916bb::g...libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
L__ZN3gmx11Constraints4Impl5applyEbblifNS_19ArrayRefWithPaddingINS_11BasicVectorIfEEEES5_NS_8ArrayRefIS4_EEPA3_KffPfS5_bPA3_fNS_18ConstraintVariableE_625__par_region2_2_180libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
shift_x(t_graph const*, float const (*) [3], float const (*) [3], float (*) [3])libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
CpuPpLongRangeNonbondeds::calculate(gmx_pme_t*, t_commrec const*, gmx::ArrayRef<gmx::BasicVector<float> const>, gmx::ForceWithVirial*, gmx_enerdata_t*, float const (*) [3], gmx::ArrayRef<float const>, gmx::ArrayRef<gmx::BasicVector<...libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
shift_self(t_graph const&, float const (*) [3], float (*) [3])libgromacs_mpi.so.7NA00NA00NA11NANANANA0.000.00NA0.000.00
minCellSizeForAtomDisplacement(gmx_mtop_t const&, t_inputrec const&, gmx::ArrayRef<gmx::RangePartitioning const>, float, ChanceTarget)libgromacs_mpi.so.7NA00NA00NA11NANANANA0.000.00NA0.000.00
void _INTERNALd56b7fc3::gmx::(anonymous namespace)::reduceThreadForceBuffers<float [4]>(_INTERNALd56b7fc3::gmx::ArrayRef<_INTERNALd56b7fc3::gmx::BasicVector<float> >, _INTERNALd56b7fc3::gmx::ArrayRef<std::unique_ptr<_INTERNALd56b7fc...libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
_INTERNALcad8b951::inc_nrnb(t_nrnb*, int, int)libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
gmx::PaddedVector<gmx::BasicVector<float>, gmx::Allocator<gmx::BasicVector<float>, gmx::AlignedAllocationPolicy> >::arrayRefWithPadding()libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
__GI___printf_fplibc-2.28.soNA00NA00NA11NANANANA0.000.00NA0.000.00
fftwf_hc2hc_applicablelibfftw3f.so.3.5.5NA0NANA0NANA1NANANANANA0.00NANA0.00NA
_IO_fprintflibc-2.28.soNA0NANA0NANA1NANANANANA0.00NANA0.00NA
hwloc__xml_import_objectlibhwloc.so.15.5.0NA0NANA0NANA1NANANANANA0.00NANA0.00NA
L__Z14spread_on_gridPK9gmx_pme_tP11PmeAtomCommPK10pmegrids_tbbPfbi_1010__par_region4_2_15libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
fftwf_md5putblibfftw3f.so.3.5.5NA0NANA0NANA1NANANANANA0.00NANA0.00NA
__libm_cos_l9libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
coslibgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
__libm_logf_l9libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
expflibgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
logflibgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
fftwf_codelet_hc2cf_20libfftw3f.so.3.5.5NA0NANA0NANA1NANANANANA0.00NANA0.00NA
wallcycle_start(gmx_wallcycle*, WallCycleCounter)libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
__kmp_get_global_thread_id_reglibiomp5.soNA00NA00NA11NANANANA0.000.00NA0.000.00
fftwf_codelet_t1buv_7_sse2libfftw3f.so.3.5.5NA0NANA0NANA1NANANANANA0.00NANA0.00NA
fftwf_codelet_t3fv_8_sse2libfftw3f.so.3.5.5NA0NANA0NANA1NANANANANA0.00NANA0.00NA
fftwf_codelet_hc2cfdftv_2_sse2libfftw3f.so.3.5.5NA0NANA0NANA1NANANANANA0.00NANA0.00NA
fftwf_codelet_n2bv_4_avxlibfftw3f.so.3.5.5NA0NANA0NANA1NANANANANA0.00NANA0.00NA
fftwf_codelet_hc2cbdftv_20_sse2libfftw3f.so.3.5.5NA0NANA0NANA1NANANANANA0.00NANA0.00NA
fftwf_codelet_n2sv_64_avxlibfftw3f.so.3.5.5NA0NANA0NANA1NANANANANA0.00NANA0.00NA
fftwf_codelet_t2fv_2_sse2libfftw3f.so.3.5.5NA0NANA0NANA1NANANANANA0.00NANA0.00NA
fftwf_codelet_t1fuv_10_sse2libfftw3f.so.3.5.5NA0NANA0NANA1NANANANANA0.00NANA0.00NA
fftwf_codelet_hc2cfdft_20libfftw3f.so.3.5.5NA0NANA0NANA1NANANANANA0.00NANA0.00NA
fftwf_codelet_t1fv_7_sse2libfftw3f.so.3.5.5NA0NANA0NANA1NANANANANA0.00NANA0.00NA
fftwf_codelet_n1bv_32_sse2libfftw3f.so.3.5.5NA0NANA0NANA1NANANANANA0.00NANA0.00NA
fftwf_codelet_n2bv_14_sse2libfftw3f.so.3.5.5NA0NANA0NANA1NANANANANA0.00NANA0.00NA
nbnxn_kernel_cpu(PairlistSet const&, Nbnxm::KernelSetup const&, nbnxn_atomdata_t*, interaction_const_t const&, gmx::ArrayRef<gmx::BasicVector<float> const>, gmx::StepWorkload const&, int, float*, float*, gmx_wallcycle*) [clone ....libgromacs_mpi.so.7NANA0NANA0NANA1NANANANANA0.00NANA0.00
fftwf_codelet_t1fuv_2_avxlibfftw3f.so.3.5.5NA0NANA0NANA1NANANANANA0.00NANA0.00NA
fftwf_codelet_t1bv_25_avxlibfftw3f.so.3.5.5NA0NANA0NANA1NANANANANA0.00NANA0.00NA
L__ZN17_INTERNALce49b59116nbnxn_kernel_cpuERK11PairlistSetRKN5Nbnxm11KernelSetupEP16nbnxn_atomdata_tRK19interaction_const_tN3gmx8ArrayRefIKNSC_11BasicVectorIfEEEERKNSC_12StepWorkloadEiPfSL_P13gmx_wallcycle_265__par_region0_2_31libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
reduce_energies_over_lists(nbnxn_atomdata_t const*, int, float*, float*)libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
gmx::ArrayRef<Nbnxm::BoundingBox const>::ArrayRef<std::vector<Nbnxm::BoundingBox, gmx::Allocator<Nbnxm::BoundingBox, gmx::AlignedAllocationPolicy> > const&, void>(std::vector<Nbnxm::BoundingBox, gmx::Allocator<Nbnxm::Bound...libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
gmx::ArrayRef<float const>::ArrayRef<std::vector<float, gmx::Allocator<float, gmx::HostAllocationPolicy> > const&, void>(std::vector<float, gmx::Allocator<float, gmx::HostAllocationPolicy> > const&)libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
fftwf_codelet_t1fv_7_avxlibfftw3f.so.3.5.5NA0NANA0NANA1NANANANANA0.00NANA0.00NA
reduceForces(nbnxn_atomdata_t*, gmx::AtomLocality, Nbnxm::GridSet const&, float (*) [3])libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
__kmpc_singlelibiomp5.soNA0NANA0NANA1NANANANANA0.00NANA0.00NA
fftwf_codelet_t2bv_25_avxlibfftw3f.so.3.5.5NA0NANA0NANA1NANANANANA0.00NANA0.00NA
__kmpc_for_static_finilibiomp5.soNA00NA00NA11NANANANA0.000.00NA0.000.00
fftwf_codelet_t3bv_4_avxlibfftw3f.so.3.5.5NA0NANA0NANA1NANANANANA0.00NANA0.00NA
fftwf_codelet_q1fv_2_avxlibfftw3f.so.3.5.5NA0NANA0NANA1NANANANANA0.00NANA0.00NA
mkl_dft_avx2_transfer_ipp_mkl_error@pltlibmkl_avx2.so.2NANA0NANA0NANA1NANANANANA0.00NANA0.00
fftwf_codelet_n1fv_2_sse2libfftw3f.so.3.5.50NANA0NANA1NANANANANA0.00NANA0.00NANA
fftwf_ifreelibfftw3f.so.3.5.500NA00.01NA11NANA1.13NA0.000.00NA0.000.00NA
fftwf_cpy2d_tiledlibfftw3f.so.3.5.50NANA0NANA1NANANANANA0.00NANA0.00NANA
fftwf_cpy1dlibfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
.plt.sec@startlibfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_plan_awakelibfftw3f.so.3.5.50NANA0NANA1NANANANANA0.00NANA0.00NANA
_dl_fixupld-2.28.so0NANA0NANA1NANANANANA0.00NANA0.00NANA
fftwf_iestimate_costlibfftw3f.so.3.5.500NA00.01NA11NANA0.38NA0.000.00NA0.000.00NA
fftwf_dft_vrank_geq1_registerlibfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
gmx::LegacySimulator::do_md()libgromacs_mpi.so.70NA00NA01NA1NANANA0.00NA0.000.00NA0.00
gmx_pme_do(gmx_pme_t*, gmx::ArrayRef<gmx::BasicVector<float> const>, gmx::ArrayRef<gmx::BasicVector<float> >, gmx::ArrayRef<float const>, gmx::ArrayRef<float const>, gmx::ArrayRef<float const>, gmx::ArrayRef<flo...libgromacs_mpi.so.7000000111NANANA0.000.000.000.000.000.00
ListedForces::haveCpuListedForces(t_fcdata const&) constlibgromacs_mpi.so.70NA00NA01NA1NANANA0.00NA0.000.00NA0.00
gmx_parallel_3dfft_real_limits(gmx_parallel_3dfft*, int*, int*, int*)libgromacs_mpi.so.7000000111NANANA0.000.000.000.000.000.00
ListedForces::calculate(gmx_wallcycle*, float const (*) [3], t_lambda const*, t_commrec const*, gmx_multisim_t const*, gmx::ArrayRefWithPadding<gmx::BasicVector<float> const>, gmx::ArrayRef<gmx::BasicVector<float> const>, t_fcdata*,...libgromacs_mpi.so.70NA00NA01NA1NANANA0.00NA0.000.00NA0.00
pme_run_mode(gmx_pme_t const*)libgromacs_mpi.so.70NANA0NANA1NANANANANA0.00NANA0.00NANA
gmx_pme_do(gmx_pme_t*, gmx::ArrayRef<gmx::BasicVector<float> const>, gmx::ArrayRef<gmx::BasicVector<float> >, gmx::ArrayRef<float const>, gmx::ArrayRef<float const>, gmx::ArrayRef<float const>, gmx::ArrayRef<flo...libgromacs_mpi.so.70NANA0NANA1NANANANANA0.00NANA0.00NANA
ListedForces::haveRestraints(t_fcdata const&) constlibgromacs_mpi.so.700NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_n1_7libfftw3f.so.3.5.500NA00.01NA11NANA2.50NA0.000.00NA0.000.00NA
fftwf_codelet_n1_15libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
strcmpld-2.28.so0NANA0NANA1NANANANANA0.00NANA0.00NANA
fftwf_rdft_solvelibfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_r2cf_16libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
__GI_getenvlibc-2.28.so0NANA0NANA1NANANANANA0.00NANA0.00NANA
fftwf_codelet_r2cf_25libfftw3f.so.3.5.50NANA0NANA1NANANANANA0.00NANA0.00NANA
fftwf_codelet_n1_11libfftw3f.so.3.5.500NA00.01NA11NANA1.88NA0.000.00NA0.000.00NA
fftwf_mkplan_rdftlibfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_t1_10libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_n1_16libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_t1_16libfftw3f.so.3.5.50NANA0NANA1NANANANANA0.00NANA0.00NANA
fftwf_codelet_t1_2libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_t1_5libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_t1_3libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_executelibfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
(anonymous namespace)::calc_one_bond(int, int, InteractionDefinitions const&, gmx::ArrayRef<int const>, int, WorkDivision const&, float const (*) [3], float (*) [4], float (*) [3], t_forcerec const*, t_pbc const*, gmx_grppairener_t*, t_nrnb*,...libgromacs_mpi.so.70NANA0NANA1NANANANANA0.00NANA0.00NANA
calculateSimpleBond(int, int, int const*, t_iparams const*, float const (*) [3], float (*) [4], float (*) [3], t_pbc const*, float, float*, gmx::ArrayRef<float const>, t_fcdata*, t_disresdata*, t_oriresdata*, int*, BondedKernelFlavor)libgromacs_mpi.so.700NA00NA11NANANANA0.000.00NA0.000.00NA
nonbonded_verlet_t::atomdata_add_nbat_f_to_f(gmx::AtomLocality, gmx::ArrayRef<gmx::BasicVector<float> >)libgromacs_mpi.so.700NA00NA11NANANANA0.000.00NA0.000.00NA
nbnxn_kernel_cpu(PairlistSet const&, Nbnxm::KernelSetup const&, nbnxn_atomdata_t*, interaction_const_t const&, gmx::ArrayRef<gmx::BasicVector<float> const>, gmx::StepWorkload const&, int, float*, float*, gmx_wallcycle*) [clone ....libgromacs_mpi.so.70NANA0NANA1NANANANANA0.00NANA0.00NANA
next_ci(Nbnxm::Grid const&, int, int, int*, int*, int*, int*)libgromacs_mpi.so.70NANA0NANA1NANANANANA0.00NANA0.00NANA
gmx::ThreadedForceBuffer<float [4]>::reduce(gmx::ForceWithShiftForces*, float*, gmx_grppairener_t*, gmx::ArrayRef<float>, gmx::StepWorkload const&, int)libgromacs_mpi.so.70NANA0NANA1NANANANANA0.00NANA0.00NANA
_intel_fast_memsetlibiomp5.so000000111NANANA0.000.000.000.000.000.00
low_do_pbc_mtop(_IO_FILE*, PbcType, float const (*) [3], gmx_mtop_t const*, float (*) [3], bool)libgromacs_mpi.so.70NANA0NANA1NANANANANA0.00NANA0.00NANA
__kmp_pop_current_task_from_threadlibiomp5.so000000111NANANA0.000.000.000.000.000.00
__kmp_get_global_thread_idlibiomp5.so0NANA0NANA1NANANANANA0.00NANA0.00NANA
__GI___libc_freelibc-2.28.so00NA00NA11NANANANA0.000.00NA0.000.00NA
__kmp_join_calllibiomp5.so000000111NANANA0.000.000.000.000.000.00
__GI___libc_memalignlibc-2.28.so00NA00NA11NANANANA0.000.00NA0.000.00NA
__kmp_api_omp_get_thread_numlibiomp5.so0NANA0NANA1NANANANANA0.00NANA0.00NANA
__kmpc_end_serialized_parallellibiomp5.so000000.01111NANA5.630.000.000.000.000.000.00
nrnbIndex(int)libgromacs_mpi.so.7000000111NANANA0.000.000.000.000.000.00
set_pbc_simd(t_pbc const*, float*)libgromacs_mpi.so.7000000111NANANA0.000.000.000.000.000.00
gmx::Constraints::Impl::apply(bool, bool, long, int, float, gmx::ArrayRefWithPadding<gmx::BasicVector<float> >, gmx::ArrayRefWithPadding<gmx::BasicVector<float> >, gmx::ArrayRef<gmx::BasicVector<float> >, float const (*)...libgromacs_mpi.so.7000000111NANANA0.000.000.000.000.000.00
do_force(_IO_FILE*, t_commrec const*, gmx_multisim_t const*, t_inputrec const&, gmx::Awh*, gmx_enfrot*, gmx::ImdSession*, pull_t*, long, t_nrnb*, gmx_wallcycle*, gmx_localtop_t const*, float const (*) [3], gmx::ArrayRefWithPadding<gmx::BasicVector&l...libgromacs_mpi.so.7000000.01111NANA0.380.000.000.000.000.000.00
do_nb_verlet(t_forcerec*, interaction_const_t const*, gmx_enerdata_t*, gmx::StepWorkload const&, gmx::InteractionLocality, int, long, t_nrnb*, gmx_wallcycle*) [clone .part.0]libgromacs_mpi.so.70NANA0NANA1NANANANANA0.00NANA0.00NANA
gmx::Update::xp()libgromacs_mpi.so.7000000111NANANA0.000.000.000.000.000.00
float (anonymous namespace)::idihs<(BondedKernelFlavor)2>(int, int const*, t_iparams const*, float const (*) [3], float (*) [4], float (*) [3], t_pbc const*, float, float*, gmx::ArrayRef<float const>, t_fcdata*, t_disresdata*, t_oriresdata*, in...libgromacs_mpi.so.70NA00NA01NA1NANANA0.00NA0.000.00NA0.00
gmx::Update::Impl::update_coords(t_inputrec const&, long, int, bool, gmx::ArrayRef<ParticleType const>, gmx::ArrayRef<float const>, gmx::ArrayRef<float const [3]>, t_state*, gmx::ArrayRefWithPadding<gmx::BasicVector<float> co...libgromacs_mpi.so.700NA00NA11NANANANA0.000.00NA0.000.00NA
wallcycleBarrier(gmx_wallcycle*)libgromacs_mpi.so.70NA00NA01NA1NANANA0.00NA0.000.00NA0.00
void gmx::settleTemplate<gmx::SimdFloat, gmx::SimdFBool, 8, float const*, false, false>(gmx::SettleData const&, int, int, float const*, float const*, float*, float, float*, float (*) [3], bool*) [clone .constprop.0]libgromacs_mpi.so.70NANA0NANA1NANANANANA0.00NANA0.00NANA
gmx::constrain_lincs(bool, t_inputrec const&, long, gmx::Lincs*, gmx::ArrayRef<float const>, t_commrec const*, gmx_multisim_t const*, gmx::ArrayRefWithPadding<gmx::BasicVector<float> const>, gmx::ArrayRefWithPadding<gmx::BasicVecto...libgromacs_mpi.so.7000000111NANANA0.000.000.000.000.000.00
gmx::constrain_coordinates(gmx::Constraints*, bool, bool, long, t_state*, gmx::ArrayRefWithPadding<gmx::BasicVector<float> >, float*, bool, float (*) [3])libgromacs_mpi.so.7000000111NANANA0.000.000.000.000.000.00
compute_globals(gmx_global_stat*, t_commrec*, t_inputrec const*, t_forcerec*, gmx_ekindata_t*, gmx::ArrayRef<gmx::BasicVector<float> const>, gmx::ArrayRef<gmx::BasicVector<float> const>, float const (*) [3], t_mdatoms const*, t_nrnb...libgromacs_mpi.so.70NANA0NANA1NANANANANA0.00NANA0.00NANA
gmx::do_constrain_first(_IO_FILE*, gmx::Constraints*, t_inputrec const*, int, int, gmx::ArrayRefWithPadding<gmx::BasicVector<float> >, gmx::ArrayRefWithPadding<gmx::BasicVector<float> >, float const (*) [3], float)libgromacs_mpi.so.7000000111NANANA0.000.000.000.000.000.00
gmx::makeLincsDeviations(gmx::Lincs const&, gmx::ArrayRef<gmx::BasicVector<float> const>, t_pbc const*) [clone .isra.0]libgromacs_mpi.so.70NANA0NANA1NANANANANA0.00NANA0.00NANA
gmx::constr_recur(gmx::ListOfLists<int> const&, std::array<InteractionList, 94ul> const&, gmx::ArrayRef<t_iparams const>, bool, int, int, int, gmx::ArrayRef<int>, float, float, float*, int*)libgromacs_mpi.so.70NA00NA01NA1NANANA0.00NA0.000.00NA0.00
_mid_memalignlibc-2.28.so00NA00.01NA11NANA0.75NA0.000.00NA0.000.00NA
__mpn_divremlibc-2.28.so0NA00NA01NA1NANANA0.00NA0.000.00NA0.00
read_intlibc-2.28.so0NANA0NANA1NANANANANA0.00NANA0.00NANA
gmx::set_lincs_matrix(gmx::Lincs*, gmx::ArrayRef<float const>, float)libgromacs_mpi.so.70NA00NA01NA1NANANA0.00NA0.000.00NA0.00
AtomProxy::residueNumber() constlibgromacs_mpi.so.700NA00NA11NANANANA0.000.00NA0.000.00NA
AtomIterator::operator++()libgromacs_mpi.so.70NA00NA01NA1NANANA0.00NA0.000.00NA0.00
gmx::constrain_lincs(bool, t_inputrec const&, long, gmx::Lincs*, gmx::ArrayRef<float const>, t_commrec const*, gmx_multisim_t const*, gmx::ArrayRefWithPadding<gmx::BasicVector<float> const>, gmx::ArrayRefWithPadding<gmx::BasicVecto...libgromacs_mpi.so.70NANA0NANA1NANANANANA0.00NANA0.00NANA
ListedForces::haveCpuBondeds() constlibgromacs_mpi.so.700NA00NA11NANANANA0.000.00NA0.000.00NA
calcBondedForces(InteractionDefinitions const&, bonded_threading_t*, float const (*) [3], t_forcerec const*, t_pbc const*, float (*) [3], gmx_enerdata_t*, t_nrnb*, gmx::ArrayRef<float const>, gmx::ArrayRef<float>, t_mdatoms const*, t_fcdata...libgromacs_mpi.so.70NANA0NANA1NANANANANA0.00NANA0.00NANA
gmx_pme_do(gmx_pme_t*, gmx::ArrayRef<gmx::BasicVector<float> const>, gmx::ArrayRef<gmx::BasicVector<float> >, gmx::ArrayRef<float const>, gmx::ArrayRef<float const>, gmx::ArrayRef<float const>, gmx::ArrayRef<flo...libgromacs_mpi.so.70NANA0NANA1NANANANANA0.00NANA0.00NANA
copyMovedAtomsToBufferPerAtom(gmx::ArrayRef<int const>, int, int, float (*) [3], gmx_domdec_comm_t*)libgromacs_mpi.so.70NANA0NANA1NANANANANA0.00NANA0.00NANA
dd_make_local_constraints(gmx_domdec_t*, int, gmx_mtop_t const&, gmx::ArrayRef<long const>, gmx::Constraints*, int, gmx::ArrayRef<InteractionList>)libgromacs_mpi.so.70NANA0NANA1NANANANANA0.00NANA0.00NANA
__strncat_avx2libc-2.28.so0NANA0NANA1NANANANANA0.00NANA0.00NANA
int make_bondeds_zone<true>(gmx_reverse_top_t const&, gmx::ArrayRef<int const>, gmx_ga2la_t const&, gmx_domdec_zones_t const&, std::vector<gmx_molblock_t, std::allocator<gmx_molblock_t> > const&, bool, int const*, bo...libgromacs_mpi.so.70NANA0NANA1NANANANANA0.00NANA0.00NANA
__memset_avx2_unalignedlibc-2.28.so00NA00NA11NANANANA0.000.00NA0.000.00NA
ddReopenBalanceRegionCpu(gmx_domdec_t const*)libgromacs_mpi.so.70NANA0NANA1NANANANANA0.00NANA0.00NANA
distributeVec(gmx_domdec_t*, gmx::ArrayRef<gmx::BasicVector<float> const>, gmx::ArrayRef<gmx::BasicVector<float> >)libgromacs_mpi.so.70NANA0NANA1NANANANANA0.00NANA0.00NANA
__strlen_avx2libc-2.28.so00NA00NA11NANANANA0.000.00NA0.000.00NA
spread_on_grid(gmx_pme_t const*, PmeAtomComm*, pmegrids_t const*, bool, bool, float*, bool, int)libgromacs_mpi.so.7000000111NANANA0.000.000.000.000.000.00
_dl_relocate_objectld-2.28.so00NA0.010NA11NA0.00NANA0.000.00NA0.000.00NA
void orderVector<gmx::BasicVector<float> >(gmx::ArrayRef<gmx_cgsort const>, gmx::ArrayRef<gmx::BasicVector<float> >, gmx::ArrayRef<gmx::BasicVector<float> >) [clone .isra.0]libgromacs_mpi.so.70NANA0.01NANA1NANA0.00NANA0.00NANA0.00NANA
atomInMolblockFromGlobalAtomnr(gmx::ArrayRef<MolblockIndices const>, int)libgromacs_mpi.so.70NANA0.01NANA1NANA0.00NANA0.00NANA0.00NANA
gmx_reverse_top_t::hasIntermolecularInteractions() constlibgromacs_mpi.so.70000.010.0101110.000.00NA0.000.000.000.000.000.00
xdrstdio_putint32(XDR*, int*)libgromacs_mpi.so.70NANA0.01NANA1NANA0.00NANA0.00NANA0.00NANA
calc_vcm_grp(t_mdatoms const&, gmx::ArrayRef<gmx::BasicVector<float> const>, gmx::ArrayRef<gmx::BasicVector<float> const>, t_vcm*) [clone ._omp_fn.0]libgromacs_mpi.so.70NANA0.01NANA1NANA6.88NANA0.00NANA0.00NANA
gmx_parallel_3dfft_execute(gmx_parallel_3dfft*, gmx_fft_direction, int, gmx_wallcycle*)libgromacs_mpi.so.7000000111NANANA0.000.000.000.000.000.00
__mempcpy_avx_unalignedlibc-2.28.so00NA0.010NA11NA0.00NANA0.000.00NA0.000.00NA
GOMP_parallel_endlibiomp5.so0NANA0.01NANA1NANA5.63NANA0.00NANA0.00NANA
fftwf_measure_execution_timelibfftw3f.so.3.5.500NA0.010.01NA11NA2.002.25NA0.000.00NA0.000.00NA
__strchrnul_avx2libc-2.28.so0000.01001110.00NANA0.000.000.000.000.000.00
_itoa_wordlibc-2.28.so0NA00.01NA0.011NA10.00NA0.000.00NA0.000.00NA0.00
_int_freelibc-2.28.so00NA0.010.01NA11NA1.381.13NA0.000.00NA0.000.00NA
fftwf_codelet_n1bv_5_avxlibfftw3f.so.3.5.500NA0.010NA11NA0.88NANA0.000.00NA0.000.00NA
__mpn_rshiftlibc-2.28.so0NANA0NANA1NANANANANA0.00NANA0.00NANA
__strncmp_avx2libc-2.28.so0NA00NA01NA1NANANA0.00NA0.000.00NA0.00
void std::vector<nbnxn_cj_t, gmx::DefaultInitializationAllocator<nbnxn_cj_t, std::allocator<nbnxn_cj_t> > >::_M_realloc_insert<nbnxn_cj_t const&>(__gnu_cxx::__normal_iterator<nbnxn_cj_t*, std::vector<nbnxn_cj_t, gmx::Defau...libgromacs_mpi.so.700NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_t1fv_25_avxlibfftw3f.so.3.5.50NANA0NANA1NANANANANA0.00NANA0.00NANA
fftwf_codelet_t1bv_5_sse2libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_t1bv_2_avxlibfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
_int_malloclibc-2.28.so00NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_q1bv_2_avxlibfftw3f.so.3.5.50NANA0NANA1NANANANANA0.00NANA0.00NANA
__kmpc_barrierlibiomp5.so0NA00NA01NA1NANANA0.00NA0.000.00NA0.00
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fftwf_codelet_n1bv_5_sse2libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_n1fv_5_sse2libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_n1bv_7_sse2libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_n1fv_15_sse2libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_n1bv_2_sse2libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_n1fv_25_sse2libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
std::vector<nbnxn_cj_t, std::allocator<nbnxn_cj_t> >::_M_default_append(unsigned long)libgromacs_mpi.so.70NANA0NANA1NANANANANA0.00NANA0.00NANA
__kmp_api_omp_get_num_threadslibiomp5.so0NANA0NANA1NANANANANA0.00NANA0.00NANA
__kmp_resume_if_soft_pausedlibiomp5.so0NANA0NANA1NANANANANA0.00NANA0.00NANA
Nbnxm::Grid::sortColumnsCpuGeometry(Nbnxm::GridSetData*, int, gmx::ArrayRef<long const>, gmx::ArrayRef<gmx::BasicVector<float> const>, nbnxn_atomdata_t*, gmx::Range<int>, gmx::ArrayRef<int>)libgromacs_mpi.so.700NA00NA11NANANANA0.000.00NA0.000.00NA
scalable_aligned_freelibiomp5.so000000111NANANA0.000.000.000.000.000.00
Nbnxm::Grid::setCellIndices(int, int, Nbnxm::GridSetData*, gmx::ArrayRef<Nbnxm::GridWork>, gmx::Range<int>, gmx::ArrayRef<long const>, gmx::ArrayRef<gmx::BasicVector<float> const>, int, nbnxn_atomdata_t*)libgromacs_mpi.so.700000.010.01111NA0.000.000.000.000.000.000.000.00
nonbonded_verlet_t::dispatchNonbondedKernel(gmx::InteractionLocality, interaction_const_t const&, gmx::StepWorkload const&, int, gmx::ArrayRef<gmx::BasicVector<float> const>, gmx::ArrayRef<float>, gmx::ArrayRef<float>, t_nrn...libgromacs_mpi.so.7000000111NANANA0.000.000.000.000.000.00
Nbnxm::GridSet::setLocalAtomOrder()libgromacs_mpi.so.70NA00NA01NA1NANANA0.00NA0.000.00NA0.00
GOMP_parallellibiomp5.so0NANA0NANA1NANANANANA0.00NANA0.00NANA
scalable_aligned_malloclibiomp5.so0NA00NA01NA1NANANA0.00NA0.000.00NA0.00
gmx::InMemoryDeserializer::doReal(float*)libgromacs_mpi.so.70NANA0NANA1NANANANANA0.00NANA0.00NANA
__kmp_serialized_parallellibiomp5.so00000.010111NA0.13NA0.000.000.000.000.000.00
_INTERNALbe3edb14::rml::internal::internalPoolMalloc(_INTERNALbe3edb14::rml::internal::MemoryPool*, unsigned long)libiomp5.so0NA00NA01NA1NANANA0.00NA0.000.00NA0.00
__kmp_fork_calllibiomp5.so000000111NANANA0.000.000.000.000.000.00
gmx::InMemoryDeserializer::doInt(int*)libgromacs_mpi.so.7000000111NANANA0.000.000.000.000.000.00
gmx::InMemorySerializer::doInt(int*)libgromacs_mpi.so.7000000111NANANA0.000.000.000.000.000.00
unknown_kernel_regionkernel000000111NANANA0.000.000.000.000.000.00
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unlink_chunk.isra.2libc-2.28.so00NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_n1fv_3_sse2libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
acosfgmx_mpiNANA0NANA0NANA1NANANANANA0.00NANA0.00
fftwf_check_alignment_of_sse2_pmlibfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_n1fv_7_sse2libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_n1fv_16_sse2libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_n1fv_11_sse2libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_n1fv_32_sse2libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
___kmp_freelibiomp5.so00NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_hc2cb_20libfftw3f.so.3.5.50NANA0NANA1NANANANANA0.00NANA0.00NANA
fftwf_codelet_r2cb_15libfftw3f.so.3.5.50NANA0NANA1NANANANANA0.00NANA0.00NANA
fftwf_codelet_hc2cb2_20libfftw3f.so.3.5.50NANA0NANA1NANANANANA0.00NANA0.00NANA
fftwf_codelet_r2cb_16libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_r2cb_64libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_r2cb_32libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_r2cb_7libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_n1bv_3_sse2libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_n1bv_15_sse2libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_t1fuv_2_sse2libfftw3f.so.3.5.50NANA0NANA1NANANANANA0.00NANA0.00NANA
fftwf_codelet_n2sv_64_sse2libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_t1fuv_3_sse2libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_t1fuv_7_sse2libfftw3f.so.3.5.50NANA0NANA1NANANANANA0.00NANA0.00NANA
fftwf_codelet_t1fuv_5_sse2libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_n1bv_11_sse2libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_n2bv_10_sse2libfftw3f.so.3.5.50NANA0NANA1NANANANANA0.00NANA0.00NANA
fftwf_codelet_n2bv_4_sse2libfftw3f.so.3.5.50NANA0NANA1NANANANANA0.00NANA0.00NANA
fftwf_codelet_n2fv_4_sse2libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_n2bv_6_sse2libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_n2fv_6_sse2libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_n2fv_14_sse2libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_n2fv_10_sse2libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_t1fv_2_sse2libfftw3f.so.3.5.50NANA0NANA1NANANANANA0.00NANA0.00NANA
fftwf_codelet_hc2cf2_20libfftw3f.so.3.5.50NANA0NANA1NANANANANA0.00NANA0.00NANA
fftwf_codelet_hf_3libfftw3f.so.3.5.50NANA0NANA1NANANANANA0.00NANA0.00NANA
fftwf_dft_generic_registerlibfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_regsolver_ct_directwlibfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
__tls_get_addrld-2.28.so000000111NANANA0.000.000.000.000.000.00
fftwf_codelet_n1_3libfftw3f.so.3.5.500NA00.01NA11NANA1.25NA0.000.00NA0.000.00NA
fftwf_dft_zerotenslibfftw3f.so.3.5.50NANA0NANA1NANANANANA0.00NANA0.00NANA
fftwf_codelet_n1_5libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_dft_bluestein_registerlibfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_tensor_appendlibfftw3f.so.3.5.50NANA0NANA1NANANANANA0.00NANA0.00NANA
fftwf_cpy2d_colibfftw3f.so.3.5.50NANA0NANA1NANANANANA0.00NANA0.00NANA
fftwf_elapsed_sincelibfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_kernel_malloclibfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
.plt.sec@startlibm-2.28.so0NANA0NANA1NANANANANA0.00NANA0.00NANA
fftwf_kernel_freelibfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_hc2cf_12libfftw3f.so.3.5.50NANA0NANA1NANANANANA0.00NANA0.00NANA
fftwf_codelet_n1_25libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_t1_15libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_r2cf_3libfftw3f.so.3.5.50NANA0NANA1NANANANANA0.00NANA0.00NANA
fftwf_rdft2_rank0_registerlibfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_r2cf_15libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_r2cf_64libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_r2cf_32libfftw3f.so.3.5.50NANA0NANA1NANANANANA0.00NANA0.00NANA
fftwf_codelet_t1_7libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
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fftwf_codelet_q1_2libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_t1_25libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_mksolver_rdft_r2r_directlibfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_t2_4libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_t2_16libfftw3f.so.3.5.50NANA0NANA1NANANANANA0.00NANA0.00NANA
fftwf_codelet_t2_8libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
malloc_consolidatelibc-2.28.so000000111NANANA0.000.000.000.000.000.00
fftwf_codelet_t1fv_3_sse2libfftw3f.so.3.5.50NANA0NANA1NANANANANA0.00NANA0.00NANA
fftwf_codelet_t1fv_10_sse2libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_t1fuv_5_avxlibfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_t1fuv_3_avxlibfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_t1fuv_7_avxlibfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_t1fv_3_avxlibfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_t1fuv_10_avxlibfftw3f.so.3.5.50NANA0NANA1NANANANANA0.00NANA0.00NANA
fftwf_codelet_t1fv_10_avxlibfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_n2bv_6_avxlibfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_n2fv_6_avxlibfftw3f.so.3.5.50NANA0NANA1NANANANANA0.00NANA0.00NANA
fftwf_codelet_n1bv_3_avxlibfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
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fftwf_codelet_n1bv_7_avxlibfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_n2fv_4_avxlibfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_n1bv_15_avxlibfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_n1bv_2_avxlibfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_t2fv_2_avxlibfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_t3fv_25_avxlibfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_t1bv_10_avxlibfftw3f.so.3.5.50NANA0NANA1NANANANANA0.00NANA0.00NANA
fftwf_codelet_t1bv_7_avxlibfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_t2bv_2_avxlibfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_q1fv_8_avxlibfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_t2sv_32_avxlibfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_t3fv_4_avxlibfftw3f.so.3.5.50NANA0NANA1NANANANANA0.00NANA0.00NANA
fftwf_codelet_t1bv_5_avxlibfftw3f.so.3.5.50NANA0NANA1NANANANANA0.00NANA0.00NANA
fftwf_codelet_t1buv_10_avxlibfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_t1buv_2_avxlibfftw3f.so.3.5.50NANA0NANA1NANANANANA0.00NANA0.00NANA
fftwf_codelet_t1bv_3_avxlibfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_t1buv_3_avxlibfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_t1buv_7_avxlibfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_t1buv_5_avxlibfftw3f.so.3.5.50NANA0NANA1NANANANANA0.00NANA0.00NANA
fftwf_codelet_t1fv_5_sse2libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_n1fv_25_avxlibfftw3f.so.3.5.50NANA0NANA1NANANANANA0.00NANA0.00NANA
fftwf_codelet_n1fv_7_avxlibfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_t1buv_10_sse2libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_t1buv_5_sse2libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_t1bv_2_sse2libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_t1bv_7_sse2libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_t1bv_3_sse2libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_t1bv_10_sse2libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_t1buv_3_sse2libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_t3fv_25_sse2libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_t1fv_25_sse2libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_t1buv_2_sse2libfftw3f.so.3.5.50NANA0NANA1NANANANANA0.00NANA0.00NANA
fftwf_codelet_t2fv_4_sse2libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_t2fv_25_sse2libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_t2fv_8_sse2libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
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fftwf_codelet_t1bv_25_sse2libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_t2bv_4_sse2libfftw3f.so.3.5.50NANA0NANA1NANANANANA0.00NANA0.00NANA
fftwf_codelet_q1bv_8_sse2libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_q1bv_2_sse2libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_n1fv_2_avxlibfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_n1fv_5_avxlibfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_n1fv_3_avxlibfftw3f.so.3.5.50NANA0NANA1NANANANANA0.00NANA0.00NANA
fftwf_codelet_t2bv_2_sse2libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_q1fv_8_sse2libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_t2sv_32_sse2libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_t2bv_8_sse2libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_q1fv_2_sse2libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_t2bv_25_sse2libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_t3bv_8_sse2libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
fftwf_codelet_t3bv_4_sse2libfftw3f.so.3.5.500NA00NA11NANANANA0.000.00NA0.000.00NA
mkl_dft_avx2_ownscDftInv_Prime8_32fc@pltlibmkl_avx2.so.2NANA0NANA0NANA1NANANANANA0.00NANA0.00
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