options

Functions

NameModuleCoverage (%)Time (s)Nb ThreadsGFLOP/sDeviation (coverage)Deviation (time)
icx-skxicx-zen3armclang-g3eicx-skxicx-zen3armclang-g3eicx-skxicx-zen3armclang-g3eicx-skxicx-zen3armclang-g3eicx-skxicx-zen3armclang-g3eicx-skxicx-zen3armclang-g3e
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.7NA61.3165.11NA178232.79NA11NA56.900.00NA0.000.00NA0.000.00
nbnxm_kernel_ElecEw_VdwLJCombLB_F_2xmm(NbnxnPairlistCpu const*, nbnxn_atomdata_t const*, interaction_const_t const*, float const (*) [3], nbnxn_atomdata_output_t*)libgromacs_mpi.so.743.39NANA140.36NANA1NANA49.81NANA0.00NANA0.00NANA
fft5d_execute(fft5d_plan_t*, int, gmx_wallcycle*)libgromacs_mpi.so.718.672.122.6160.396.149.331110.000.020.000.000.000.000.000.000.00
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.7NA9.4710.4NA27.537.17NA11NA67.040.00NA0.000.00NA0.000.00
gather_f_bsplines(gmx_pme_t const*, float const*, bool, PmeAtomComm const*, splinedata_t const*, float)libgromacs_mpi.so.74.23.50.9113.610.173.2511114.9630.060.000.000.000.000.000.000.00
spread_on_grid(gmx_pme_t const*, PmeAtomComm*, pmegrids_t const*, bool, bool, float*, bool, int) [clone .extracted.11]libgromacs_mpi.so.74.424.16NA14.312.09NA11NA4.998.41NA0.000.00NA0.000.00NA
nbnxm_kernel_ElecEw_VdwLJCombLB_VF_2xmm(NbnxnPairlistCpu const*, nbnxn_atomdata_t const*, interaction_const_t const*, float const (*) [3], nbnxn_atomdata_output_t*)libgromacs_mpi.so.76.47NANA20.94NANA1NANA57.97NANA0.00NANA0.00NANA
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.73.551.910.7611.475.542.711112.743.200.000.000.000.000.000.000.00
Unknown functionanonNANA4.05NANA14.49NANA1NANA0.00NANA0.00NANA0.00
solve_pme_yzx(gmx_pme_t const*, t_complex*, float, bool, int, int)libgromacs_mpi.so.71.610.760.745.212.212.6411110.3237.730.000.000.000.000.000.000.00
.omp_outlined..2libgromacs_mpi.so.7NANA2.59NANA9.27NANA1NANA0.00NANA0.00NANA0.00
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.70.70.680.812.271.982.881118.0714.120.000.000.000.000.000.000.00
std::enable_if<((4)==(4))||((4)==(5)), gmx::BasicVector<float> >::type do_fspline::operator()<4>(std::integral_constant<int, 4>) constlibgromacs_mpi.so.7NANA2.09NANA7.49NANA1NANA0.00NANA0.00NANA0.00
PairlistSet::constructPairlists(gmx::InteractionLocality, Nbnxm::GridSet const&, gmx::ArrayRef<PairsearchWork>, nbnxn_atomdata_t*, gmx::ListOfLists<int> const&, int, t_nrnb*, SearchCycleCounting*) [clone .extracted.68]libgromacs_mpi.so.72.05NANA6.62NANA1NANA2.44NANA0.00NANA0.00NANA
nbnxn_kernel_prune_4xn(NbnxnPairlistCpu*, nbnxn_atomdata_t const*, gmx::ArrayRef<gmx::BasicVector<float> const>, float)libgromacs_mpi.so.7NA1.040.94NA3.033.37NA11NA56.360.00NA0.000.00NA0.000.00
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.710.73NA3.232.13NA11NA3.217.65NA0.000.00NA0.000.00NA
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.70.920.370.332.981.061.1711111.7020.170.000.000.000.000.000.000.00
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.7NA0.830.75NA2.412.66NA11NA16.570.00NA0.000.00NA0.000.00
PairlistSet::constructPairlists(gmx::InteractionLocality, Nbnxm::GridSet const&, gmx::ArrayRef<PairsearchWork>, nbnxn_atomdata_t*, gmx::ListOfLists<int> const&, int, t_nrnb*, SearchCycleCounting*) [clone .extracted.67]libgromacs_mpi.so.7NA1.44NANA4.19NANA1NANA4.76NANA0.00NANA0.00NA
spread_on_grid(gmx_pme_t const*, PmeAtomComm*, pmegrids_t const*, bool, bool, float*, bool, int) [clone .extracted.18]libgromacs_mpi.so.70.790.56NA2.561.63NA11NA2.215.50NA0.000.00NA0.000.00NA
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.70.560.370.281.821.070.991113.9111.140.000.000.000.000.000.000.00
(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.7NA0.490.7NA1.432.52NA11NA14.040.00NA0.000.00NA0.000.00
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.7NA0.550.62NA1.592.2NA11NA6.770.00NA0.000.00NA0.000.00
.omp_outlined..8libgromacs_mpi.so.7NANA1.13NANA4.02NANA1NANA0.00NANA0.00NANA0.00
__intel_avx_rep_memcpygmx_mpi0.710.37NA2.311.06NA11NA0.000.00NA0.000.00NA0.000.00NA
pbc_dx_aiuc(t_pbc const*, float const*, float const*, float*)libgromacs_mpi.so.70.390.420.181.261.20.661111.713.020.000.000.000.000.000.000.00
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.70.84002.71001118.97NANA0.000.000.000.000.000.00
nbnxn_kernel_prune_2xnn(NbnxnPairlistCpu*, nbnxn_atomdata_t const*, gmx::ArrayRef<gmx::BasicVector<float> const>, float)libgromacs_mpi.so.70.82NANA2.64NANA1NANA43.15NANA0.00NANA0.00NANA
__intel_avx_rep_memsetgmx_mpi0.380.4NA1.231.16NA11NA0.000.08NA0.000.00NA0.000.00NA
mkl_dft_avx512_mg_rowbatch_plain_fwd_096_slibmkl_avx512.so.20.74NANA2.39NANA1NANA23.10NANA0.00NANA0.00NANA
.omp_outlined..36libgromacs_mpi.so.7NANA0.72NANA2.58NANA1NANA0.00NANA0.00NANA0.00
mkl_dft_avx2_ownscDftFwd_Prime8_32fclibmkl_avx2.so.2NA0.72NANA2.1NANA1NANA22.60NANA0.00NANA0.00NA
mkl_dft_avx2_ownscDftInv_Prime8_32fclibmkl_avx2.so.2NA0.71NANA2.06NANA1NANA22.59NANA0.00NANA0.00NA
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.70.320.32NA1.020.94NA11NA5.839.56NA0.000.00NA0.000.00NA
void do_pairs_simple<gmx::SimdFloat, 16, float const*>(int, int const*, t_iparams const*, float const (*) [3], float (*) [4], float const*, gmx::ArrayRef<float>, float)libgromacs_mpi.so.70.63NANA2.05NANA1NANA4.27NANA0.00NANA0.00NANA
copy_rvec_to_nbat_real(int const*, int, int, float const (*) [3], int, float*, int)libgromacs_mpi.so.70.240.220.150.770.630.541110.000.000.000.000.000.000.000.000.00
(anonymous namespace)::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, float (*) [4])libgromacs_mpi.so.7NANA0.58NANA2.06NANA1NANA0.00NANA0.00NANA0.00
mkl_dft_avx512_mg_rowbatch_plain_bwd_096_slibmkl_avx512.so.20.56NANA1.8NANA1NANA28.76NANA0.00NANA0.00NANA
reduceForces(nbnxn_atomdata_t*, gmx::AtomLocality, Nbnxm::GridSet const&, float (*) [3]) [clone .extracted]libgromacs_mpi.so.70.260.2NA0.830.57NA11NA1.061.46NA0.000.00NA0.000.00NA
.omp_outlined.#0x931c04libgromacs_mpi.so.7NANA0.45NANA1.6NANA1NANA0.00NANA0.00NANA0.00
dih_angle(float const*, float const*, float const*, float const*, t_pbc const*, float*, float*, float*, float*, float*, int*, int*, int*)libgromacs_mpi.so.70.120.130.130.380.360.461111.552.770.000.000.000.000.000.000.00
_ZN12_GLOBAL__N_124do_dih_fup_noshiftf_simdEPKiS1_S1_S1_N3gmx9SimdFloatES3_S3_S3_S3_S3_S3_S3_PA4_f@@608libgromacs_mpi.so.70.38NANA1.21NANA1NANA6.12NANA0.00NANA0.00NANA
energyDriftAtomPair(bool, bool, float, float, float, float, pot_derivatives_t const*)libgromacs_mpi.so.70.180.090.10.590.270.341111.834.380.000.000.000.000.000.000.00
mkl_dft_avx512_ipps_cFFTfwd_64_32fclibmkl_avx512.so.20.36NANA1.17NANA1NANA17.50NANA0.00NANA0.00NANA
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.70.130.130.10.40.370.341112.132.850.000.000.000.000.000.000.00
mkl_dft_avx2_ipps_cFFTfwd_64_32fclibmkl_avx2.so.2NA0.35NANA1.02NANA1NANA12.58NANA0.00NANA0.00NA
setupForceOutputs(ForceHelperBuffers*, gmx::ArrayRefWithPadding<gmx::BasicVector<float> >, gmx::DomainLifetimeWorkload const&, gmx::StepWorkload const&, bool, gmx_wallcycle*)libgromacs_mpi.so.70.140.150.050.440.440.171110.000.000.000.000.000.000.000.000.00
mkl_dft_avx2_ownscDftInv_Fact3_32fclibmkl_avx2.so.2NA0.33NANA0.95NANA1NANA17.86NANA0.00NANA0.00NA
mkl_dft_avx512_ipps_cFFTinv_64_32fclibmkl_avx512.so.20.33NANA1.08NANA1NANA21.48NANA0.00NANA0.00NANA
_ZN12_GLOBAL__N_124do_dih_fup_noshiftf_simdEPKiS1_S1_S1_N3gmx9SimdFloatES3_S3_S3_S3_S3_S3_S3_PA4_f@@296libgromacs_mpi.so.7NA0.33NANA0.95NANA1NANA26.17NANA0.00NANA0.00NA
mkl_dft_avx2_ownscDftFwd_Fact4_32fclibmkl_avx2.so.2NA0.33NANA0.95NANA1NANA6.37NANA0.00NANA0.00NA
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.70.090.070.170.290.190.591112.522.780.000.000.000.000.000.000.00
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.70.120.090.120.40.250.431114.902.350.000.000.000.000.000.000.00
mkl_dft_avx2_ownscDftInv_Fact4_32fclibmkl_avx2.so.2NA0.31NANA0.9NANA1NANA5.78NANA0.00NANA0.00NA
mkl_dft_avx2_ownscDftFwd_Fact3_32fclibmkl_avx2.so.2NA0.31NANA0.9NANA1NANA18.69NANA0.00NANA0.00NA
evaluate_single(float, float, float const*, float, float, float, float, float*, float*)libgromacs_mpi.so.70.180.12NA0.570.35NA11NA1.072.80NA0.000.00NA0.000.00NA
mkl_dft_avx2_owns_cCcsRecombine_32flibmkl_avx2.so.2NA0.29NANA0.84NANA1NANA12.48NANA0.00NANA0.00NA
mkl_dft_avx512_owns_cRealRecombine_32flibmkl_avx512.so.20.28NANA0.91NANA1NANA12.52NANA0.00NANA0.00NANA
bond_angle(float const*, float const*, float const*, t_pbc const*, float*, float*, float*, int*, int*)libgromacs_mpi.so.70.090.120.060.280.360.21111.684.940.000.000.000.000.000.000.00
copy_pmegrid_to_fftgrid(gmx_pme_t const*, float const*, float*, int)libgromacs_mpi.so.70.010.010.240.020.040.841110.000.000.000.000.000.000.000.000.00
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.70.160.1NA0.510.3NA11NA0.000.00NA0.000.00NA0.000.00NA
__libm_atan2f_l9gmx_mpi0.170.08NA0.550.23NA11NA0.963.74NA0.000.00NA0.000.00NA
__libm_sincosf_e7gmx_mpi0.130.11NA0.40.32NA11NA1.302.55NA0.000.00NA0.000.00NA
mkl_dft_avx2_owns_cRealRecombine_32flibmkl_avx2.so.2NA0.24NANA0.69NANA1NANA17.89NANA0.00NANA0.00NA
DftiComputeBackwardlibmkl_intel_lp64.so.20.090.15NA0.30.43NA11NA21.8726.46NA0.000.00NA0.000.00NA
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.70.130.080.030.430.240.11111.232.840.000.000.000.000.000.000.00
gmx::ThreadForceBuffer<float [4]>::clearForcesAndEnergies()libgromacs_mpi.so.70.130.070.030.410.20.111110.000.000.000.000.000.000.000.000.00
DftiComputeForwardlibmkl_intel_lp64.so.20.110.11NA0.370.3NA11NA19.4629.93NA0.000.00NA0.000.00NA
mkl_dft_avx2_ipps_cFFTinv_64_32fclibmkl_avx2.so.2NA0.22NANA0.63NANA1NANA22.52NANA0.00NANA0.00NA
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.70.130.08NA0.420.24NA11NA1.553.47NA0.000.00NA0.000.00NA
wrap_periodic_pmegrid(gmx_pme_t const*, float*)libgromacs_mpi.so.70.10.050.050.310.130.181110.741.550.000.000.000.000.000.000.00
__libm_erfcf_exgmx_mpi0.090.1NA0.270.28NA11NA2.002.92NA0.000.00NA0.000.00NA
copy_fftgrid_to_pmegrid(gmx_pme_t*, float const*, float*, int, int, int)libgromacs_mpi.so.70.050.010.120.150.040.441110.000.060.000.000.000.000.000.000.00
.omp_outlined..19#0x889adclibgromacs_mpi.so.7NANA0.16NANA0.56NANA1NANA0.00NANA0.00NANA0.00
mkl_dft_avx512_owns_cCcsRecombine_32flibmkl_avx512.so.20.16NANA0.51NANA1NANA13.53NANA0.00NANA0.00NANA
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.70.080.08NA0.250.24NA11NA5.089.96NA0.000.00NA0.000.00NA
Unknown functionlibgromacs_mpi.so.70.060.040.040.180.120.131118.563.560.000.000.000.000.000.000.00
.omp_outlined.#0x867d00libgromacs_mpi.so.7NANA0.14NANA0.5NANA1NANA0.00NANA0.00NANA0.00
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.70.080.020.040.250.060.141119.6032.710.000.000.000.000.000.000.00
__libm_exp_l9gmx_mpi0.080.05NA0.250.15NA11NA0.763.17NA0.000.00NA0.000.00NA
__libm_acosf_l9gmx_mpi0.090.04NA0.280.1NA11NA0.112.76NA0.000.00NA0.000.00NA
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.70.050.030.040.150.080.141110.000.000.000.000.000.000.000.000.00
mkl_serv_verbose_modelibmkl_core.so.20.040.07NA0.120.19NA11NA0.0018.86NA0.000.00NA0.000.00NA
void armpl::fft::execute_dit<std::complex<float>, std::complex<float>, std::complex<float> >(armpl::fft::composition<std::complex<float>, std::complex<float> > const&, long, std::complex<float>*, std::com...libarmpl.soNANA0.11NANA0.41NANA1NANA0.00NANA0.00NANA0.00
mkl_dft_avx2_ownscDftInv_PrimeFact_32fclibmkl_avx2.so.2NA0.11NANA0.31NANA1NANA19.69NANA0.00NANA0.00NA
.omp_outlined..25libgromacs_mpi.so.7NANA0.11NANA0.39NANA1NANA0.00NANA0.00NANA0.00
unwrap_periodic_pmegrid(gmx_pme_t*, float*) [clone .extracted]libgromacs_mpi.so.70.060.04NA0.20.11NA11NA0.000.00NA0.000.00NA0.000.00NA
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.70.030.030.030.080.070.091110.000.000.000.000.000.000.000.000.00
mkl_dft_avx512_ippsFFTInv_CCSToR_32flibmkl_avx512.so.20.09NANA0.29NANA1NANA6.07NANA0.00NANA0.00NANA
calcVerletBufferSize(gmx_mtop_t const&, float, t_inputrec const&, int, int, float, VerletbufListSetup const&)libgromacs_mpi.so.70.040.020.020.140.060.061112.143.520.000.000.000.000.000.000.00
__exp_finitelibamath_aarch64.soNANA0.08NANA0.29NANA1NANA0.00NANA0.00NANA0.00
.omp_outlined..17libgromacs_mpi.so.7NANA0.08NANA0.28NANA1NANA0.00NANA0.00NANA0.00
mkl_dft_avx2_ownscDftFwd_PrimeFact_32fclibmkl_avx2.so.2NA0.08NANA0.22NANA1NANA27.27NANA0.00NANA0.00NA
__libm_expf_l9gmx_mpi0.030.04NA0.090.12NA11NA1.333.07NA0.000.00NA0.000.00NA
gmx_fft_1d(gmx_fft*, gmx_fft_direction, void*, void*)libgromacs_mpi.so.70.040.03NA0.130.07NA11NA45.5434.93NA0.000.00NA0.000.00NA
void armpl::fft::execute_dif<std::complex<float>, float, std::complex<float> >(armpl::fft::composition<std::complex<float>, float> const&, long, std::complex<float>*, float*, long, long, long, long, std::complex<f...libarmpl.soNANA0.06NANA0.23NANA1NANA0.00NANA0.00NANA0.00
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.70.040.010.010.120.040.041111.502.530.000.000.000.000.000.000.00
compute_mg_row_fwdlibmkl_avx512.so.20.06NANA0.18NANA1NANA5.33NANA0.00NANA0.00NANA
quicksortgmx_mpi0.06NANA0.18NANA1NANA0.00NANA0.00NANA0.00NANA
compute_mg_row_bwdlibmkl_avx512.so.20.06NANA0.18NANA1NANA2.22NANA0.00NANA0.00NANA
__fs_sin_1libamath_aarch64.soNANA0.06NANA0.22NANA1NANA0.00NANA0.00NANA0.00
gmx_fft_many_1d(gmx_fft*, gmx_fft_direction, void*, void*)libgromacs_mpi.so.70.040.02NA0.110.07NA11NA18.9118.41NA0.000.00NA0.000.00NA
pthread_attr_setschedparamlibc-2.31.soNANA0.06NANA0.21NANA1NANA0.00NANA0.00NANA0.00
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.70.030.03NA0.080.07NA11NA0.000.00NA0.000.00NA0.000.00NA
.omp_outlined..14libgromacs_mpi.so.7NANA0.06NANA0.2NANA1NANA0.00NANA0.00NANA0.00
clearForceBuffer(nbnxn_atomdata_t*, int)libgromacs_mpi.so.7000.06000.2111NANA0.000.000.000.000.000.000.00
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.70.030.020.010.10.060.051110.000.000.000.000.000.000.000.000.00
__fs_atan2_1libamath_aarch64.soNANA0.06NANA0.2NANA1NANA0.00NANA0.00NANA0.00
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.70.030.010.010.10.040.031110.000.000.000.000.000.000.000.000.00
Nbnxm::sort_atoms(int, bool, int, bool, int*, int, gmx::ArrayRef<gmx::BasicVector<float> const>, float, float, int, gmx::ArrayRef<int>)libgromacs_mpi.so.70.030.02NA0.10.07NA11NA0.300.18NA0.000.00NA0.000.00NA
compute_1d_small_bwdlibmkl_avx2.so.2NA0.05NANA0.14NANA1NANA19.46NANA0.00NANA0.00NA
gmx_fft_1d_real(gmx_fft*, gmx_fft_direction, void*, void*)libgromacs_mpi.so.70.030.02NA0.090.05NA11NA16.0034.30NA0.000.00NA0.000.00NA
compute_1d_small_fwdlibmkl_avx2.so.2NA0.05NANA0.15NANA1NANA31.03NANA0.00NANA0.00NA
globalAtomIndexToMoltypeIndices(gmx::ArrayRef<MolblockIndices const>, int)libgromacs_mpi.so.70.020.020.010.050.050.021110.000.000.000.000.000.000.000.000.00
void armpl::fft::execute_dit<float, std::complex<float>, std::complex<float> >(armpl::fft::composition<float, std::complex<float> > const&, long, float*, std::complex<float>*, long, long, long, long, std::complex<...libarmpl.soNANA0.05NANA0.17NANA1NANA0.00NANA0.00NANA0.00
mkl_dft_avx2_ippsFFTInv_CCSToR_32flibmkl_avx2.so.2NA0.05NANA0.15NANA1NANA22.34NANA0.00NANA0.00NA
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.70.010.030.010.020.070.041110.000.000.000.000.000.000.000.000.00
sloejit::function::finalise(sloejit::stack_frame_info const*)libarmpl.soNANA0.04NANA0.14NANA1NANA0.00NANA0.00NANA0.00
acosflibm-2.31.soNANA0.04NANA0.14NANA1NANA0.00NANA0.00NANA0.00
compute_1d_small_bwdlibmkl_avx512.so.20.04NANA0.12NANA1NANA18.67NANA0.00NANA0.00NANA
mkl_dft_avx512_ippsDFTInv_CCSToR_32flibmkl_avx512.so.20.04NANA0.13NANA1NANA0.00NANA0.00NANA0.00NANA
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.70.020.010.010.080.040.031110.000.000.000.000.000.000.000.000.00
__expf_finitelibamath_aarch64.soNANA0.04NANA0.13NANA1NANA0.00NANA0.00NANA0.00
mkl_dft_avx512_ippsFFTFwd_RToPerm_32flibmkl_avx512.so.20.04NANA0.14NANA1NANA12.57NANA0.00NANA0.00NANA
atoms2md(gmx_mtop_t const&, t_inputrec const&, int, gmx::ArrayRef<int>, int, gmx::MDAtoms*) [clone .extracted]libgromacs_mpi.so.70.020.02NA0.080.07NA11NA0.000.09NA0.000.00NA0.000.00NA
parse_printf_formatlibc.so.60.04NANA0.14NANA1NANA0.00NANA0.00NANA0.00NANA
calc_vir(int, float const (*) [3], float const (*) [3], float (*) [3], bool, float const (*) [3])libgromacs_mpi.so.70.020.02NA0.070.07NA11NA10.7114.55NA0.000.00NA0.000.00NA
calc_x_times_f(int, float const (*) [3], float const (*) [3], bool, float const (*) [3], float (*) [3]) [clone .1] [clone .extracted]libgromacs_mpi.so.7NANA0.03NANA0.11NANA1NANA0.00NANA0.00NANA0.00
unwrap_periodic_pmegrid(gmx_pme_t*, float*)libgromacs_mpi.so.70.010.0200.020.0501110.000.00NA0.000.000.000.000.000.00
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.70.020.01NA0.060.04NA11NA1.832.56NA0.000.00NA0.000.00NA
gmx_fft_many_1d_real(gmx_fft*, gmx_fft_direction, void*, void*)libgromacs_mpi.so.70.020.01NA0.060.04NA11NA29.3316.69NA0.000.00NA0.000.00NA
mkl_dft_avx2_ippsDFTInv_CToC_32fclibmkl_avx2.so.2NA0.03NANA0.09NANA1NANA36.08NANA0.00NANA0.00NA
__GI___printf_fp_llibc-2.28.soNA0.03NANA0.07NANA1NANA0.00NANA0.00NANA0.00NA
std::vector<int, std::allocator<int> >::_M_default_append(unsigned long)libgromacs_mpi.so.70.020.01NA0.050.02NA11NA0.000.00NA0.000.00NA0.000.00NA
dd_redistribute_cg(_IO_FILE*, long, gmx_domdec_t*, int*, t_state*, t_forcerec*, t_nrnb*, int*)libgromacs_mpi.so.70.010.010.010.030.020.021110.000.000.000.000.000.000.000.000.00
mkl_dft_avx2_ippsDFTFwd_RToCCS_32flibmkl_avx2.so.2NA0.03NANA0.09NANA1NANA27.83NANA0.00NANA0.00NA
setup_bonded_threading(bonded_threading_t*, int, bool, InteractionDefinitions const&) [clone .extracted]libgromacs_mpi.so.70.020.01NA0.070.02NA11NA0.000.00NA0.000.00NA0.000.00NA
mkl_dft_avx2_ippsFFTFwd_RToPerm_32flibmkl_avx2.so.2NA0.03NANA0.1NANA1NANA18.44NANA0.00NANA0.00NA
mkl_dft_avx512_ippsDFTFwd_RToCCS_32flibmkl_avx512.so.20.03NANA0.09NANA1NANA30.22NANA0.00NANA0.00NANA
mkl_dft_avx2_ippsDFTFwd_CToC_32fclibmkl_avx2.so.2NA0.03NANA0.09NANA1NANA33.90NANA0.00NANA0.00NA
__cosf_finitelibamath_aarch64.soNANA0.02NANA0.05NANA1NANA0.00NANA0.00NANA0.00
mkl_dft_avx2_ippsDFTInv_CCSToR_32flibmkl_avx2.so.2NA0.02NANA0.07NANA1NANA21.39NANA0.00NANA0.00NA
vprintflibc-2.31.soNANA0.02NANA0.08NANA1NANA0.00NANA0.00NANA0.00
__nss_database_lookuplibc-2.31.soNANA0.02NANA0.08NANA1NANA0.00NANA0.00NANA0.00
_IO_vfprintflibc-2.28.soNA0.02NANA0.06NANA1NANA0.00NANA0.00NANA0.00NA
__mth_i_erfclibamath_aarch64.soNANA0.02NANA0.05NANA1NANA0.00NANA0.00NANA0.00
nbnxn_atomdata_set(nbnxn_atomdata_t*, Nbnxm::GridSet const&, gmx::ArrayRef<int const>, gmx::ArrayRef<float const>, gmx::ArrayRef<long const>)libgromacs_mpi.so.70.010.01NA0.020.02NA11NA0.000.00NA0.000.00NA0.000.00NA
gmx::set_lincs(InteractionDefinitions const&, int, gmx::ArrayRef<float const>, float, bool, t_commrec const*, gmx::Lincs*) [clone .extracted]libgromacs_mpi.so.70.010.01NA0.020.02NA11NA0.000.00NA0.000.00NA0.000.00NA
mkl_serv_verbose_mode@pltlibmkl_intel_lp64.so.20.020NA0.050NA11NA0.00NANA0.000.00NA0.000.00NA
gmx::set_lincs_matrix(gmx::Lincs*, gmx::ArrayRef<float const>, float) [clone .extracted]libgromacs_mpi.so.70.020NA0.050.01NA11NA0.201.13NA0.000.00NA0.000.00NA
__xpg_basenamelibc.so.60.02NANA0.06NANA1NANA0.00NANA0.00NANA0.00NANA
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.70.010.01NA0.040.03NA11NA2.504.21NA0.000.00NA0.000.00NA
dd_redistribute_cg(_IO_FILE*, long, gmx_domdec_t*, int*, t_state*, t_forcerec*, t_nrnb*, int*) [clone .extracted]libgromacs_mpi.so.70.010.01NA0.040.02NA11NA0.000.00NA0.000.00NA0.000.00NA
sum_forces(gmx::ArrayRef<gmx::BasicVector<float> >, gmx::ArrayRef<gmx::BasicVector<float> const>) [clone .extracted]libgromacs_mpi.so.70.010.01NA0.040.03NA11NA4.004.75NA0.000.00NA0.000.00NA
nral_rt(int)libgromacs_mpi.so.700.02NA0.010.06NA11NA0.000.00NA0.000.00NA0.000.00NA
compute_1d_small_fwdlibmkl_avx512.so.20.02NANA0.08NANA1NANA16.00NANA0.00NANA0.00NANA
mkl_dft_avx512_transfer_ipp_mkl_errorlibmkl_avx512.so.20.02NANA0.05NANA1NANA41.60NANA0.00NANA0.00NANA
_IO_file_xsputnlibc-2.28.soNA0.01NANA0.02NANA1NANA0.00NANA0.00NANA0.00NA
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.70.01NA00.04NA0.011NA10.00NA0.000.00NA0.000.00NA0.00
strchrnullibc-2.31.soNANA0.01NANA0.02NANA1NANA0.00NANA0.00NANA0.00
__nss_database_lookuplibc.so.60.01NANA0.04NANA1NANA0.00NANA0.00NANA0.00NANA
.omp_outlined.#0x90f7e8libgromacs_mpi.so.7NANA0.01NANA0.02NANA1NANA0.00NANA0.00NANA0.00
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.70.010NA0.030NA11NA0.00NANA0.000.00NA0.000.00NA
std::_Rb_tree_insert_and_rebalance(bool, std::_Rb_tree_node_base*, std::_Rb_tree_node_base*, std::_Rb_tree_node_base&)libstdc++.so.6.0.29NANA0.01NANA0.02NANA1NANA0.00NANA0.00NANA0.00
mk_mshift(_IO_FILE*, t_graph*, PbcType, float const (*) [3], float const (*) [3])libgromacs_mpi.so.70.01000.030.010.011110.002.380.000.000.000.000.000.000.00
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.70.01000.02001110.50NANA0.000.000.000.000.000.00
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.70.01000.020.0101110.501.75NA0.000.000.000.000.000.00
gmx::makeAtomsToConstraintsList(int, gmx::ArrayRef<InteractionList const>, gmx::ArrayRef<t_iparams const>, gmx::FlexibleConstraintTreatment)libgromacs_mpi.so.7NA0.010NA0.020.01NA11NA0.000.00NA0.000.00NA0.000.00
_IO_vfprintflibc.so.60.01NANA0.04NANA1NANA0.00NANA0.00NANA0.00NANA
_ZNSt6vectorIiSaIiEE17_M_default_appendEm.26.extracted#0x502c6clibgromacs_mpi.so.7NANA0.01NANA0.02NANA1NANA0.00NANA0.00NANA0.00
_IO_fwritelibc-2.28.soNA0.01NANA0.02NANA1NANA0.00NANA0.00NANA0.00NA
unwrap_periodic_pmegrid(gmx_pme_t*, float*) [clone .extracted.31]libgromacs_mpi.so.7NA0.01NANA0.04NANA1NANA0.00NANA0.00NANA0.00NA
dd_check_ftype(int, ReverseTopOptions const&)libgromacs_mpi.so.7NA0.010NA0.020.01NA11NA0.000.00NA0.000.00NA0.000.00
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.70.01NANA0.04NANA1NANA0.00NANA0.00NANA0.00NANA
mkl_dft_avx2_ownscDftInv_PrimeFact_32fc@pltlibmkl_avx2.so.2NA0.01NANA0.01NANA1NANA13.38NANA0.00NANA0.00NA
unknown_kernel_regionkernel0.010NA0.020NA11NA0.00NANA0.000.00NA0.000.00NA
hack_digitlibc-2.28.soNA0.01NANA0.01NANA1NANA0.00NANA0.00NANA0.00NA
unwrap_periodic_pmegrid(gmx_pme_t*, float*) [clone .extracted.30]libgromacs_mpi.so.70.01NANA0.04NANA1NANA0.00NANA0.00NANA0.00NANA
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 .57] [clone .extracted]libgromacs_mpi.so.7NANA0.01NANA0.02NANA1NANA0.00NANA0.00NANA0.00
swapcontextlibc-2.31.soNANA0.01NANA0.02NANA1NANA0.00NANA0.00NANA0.00
getVerletBufferAtomtypes(gmx_mtop_t const&, bool, bool)libgromacs_mpi.so.70.01000.020.0101110.000.00NA0.000.000.000.000.000.00
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.70.01000.020.0101110.000.00NA0.000.000.000.000.000.00
__exp1libamath_aarch64.soNANA0.01NANA0.04NANA1NANA0.00NANA0.00NANA0.00
armpl::wfta::do_dedup(armpl::wfta::ir_value_scope*)libarmpl.soNANA0.01NANA0.04NANA1NANA0.00NANA0.00NANA0.00
apply_physical_subs(sloejit::arch_traits const*, sloejit::regset_one_space const&, sloejit::regmap<sloejit::reg> const&)libarmpl.soNANA0.01NANA0.03NANA1NANA0.00NANA0.00NANA0.00
Nbnxm::sort_atoms(int, bool, int, bool, int*, int, gmx::ArrayRef<gmx::BasicVector<float> const>, float, float, int, gmx::ArrayRef<int>) [clone .23] [clone .extracted]libgromacs_mpi.so.7NANA0.01NANA0.03NANA1NANA0.00NANA0.00NANA0.00
.omp_outlined.#0x861a44libgromacs_mpi.so.7NANA0.01NANA0.03NANA1NANA0.00NANA0.00NANA0.00
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.70.01NANA0.02NANA1NANA0.00NANA0.00NANA0.00NANA
__aarch64_ldadd4_acq_rellibarmpl.soNANA0.01NANA0.04NANA1NANA0.00NANA0.00NANA0.00
.omp_outlined..3#0x923ef8libgromacs_mpi.so.7NANA0.01NANA0.04NANA1NANA0.00NANA0.00NANA0.00
gmx_reverse_top_t::molblockIndices() constlibgromacs_mpi.so.700.01NA00.01NA11NANA0.00NA0.000.00NA0.000.00NA
.omp_outlined.#0x869790libgromacs_mpi.so.7NANA0.01NANA0.04NANA1NANA0.00NANA0.00NANA0.00
__libm_exp_k32gmx_mpi00.01NA0.010.02NA11NA3.001.88NA0.000.00NA0.000.00NA
.omp_outlined..19libgromacs_mpi.so.7NANA0.01NANA0.04NANA1NANA0.00NANA0.00NANA0.00
.omp_outlined.#0x4f4404libgromacs_mpi.so.7NANA0.01NANA0.05NANA1NANA0.00NANA0.00NANA0.00
.omp_outlined.#0x5113b8libgromacs_mpi.so.7NANA0.01NANA0.03NANA1NANA0.00NANA0.00NANA0.00
gmx::InMemoryDeserializer::doFloat(float*)libgromacs_mpi.so.700.01000.010.01111NA0.000.000.000.000.000.000.000.00
psiginfolibc-2.31.soNANA0.01NANA0.03NANA1NANA0.00NANA0.00NANA0.00
__libc_malloclibc-2.31.soNANA0.01NANA0.03NANA1NANA0.00NANA0.00NANA0.00
atan2fgmx_mpi0.010NA0.020NA11NA2.00NANA0.000.00NA0.000.00NA
gmx::InMemoryDeserializer::doReal(float*)libgromacs_mpi.so.70.01NANA0.02NANA1NANA0.00NANA0.00NANA0.00NANA
_intel_fast_memcpygmx_mpi00.01NA0.010.01NA11NA0.000.25NA0.000.00NA0.000.00NA
gmx::ListOfLists<int>::pushBack(gmx::ArrayRef<int const>)libgromacs_mpi.so.700.01NA0.010.02NA11NA0.000.00NA0.000.00NA0.000.00NA
__acosf_finitelibm-2.31.soNANA0.01NANA0.02NANA1NANA0.00NANA0.00NANA0.00
sloejit::regmap<sloejit::regset_one_space>::operator[](sloejit::reg)libarmpl.soNANA0.01NANA0.02NANA1NANA0.00NANA0.00NANA0.00
sloejit::live_positions::emplace(sloejit::block*, sloejit::reg, sloejit::instruction*, bool, bool, bool)libarmpl.soNANA0.01NANA0.02NANA1NANA0.00NANA0.00NANA0.00
@plt_start@libarmpl.soNANA0NANA0.01NANA1NANA0.00NANA0.00NANA0.00
armpl::wfta::do_opt(armpl::wfta::target const&, armpl::wfta::ir_value_scope*)libarmpl.soNANA0NANA0.01NANA1NANA0.00NANA0.00NANA0.00
__kmp_fork_calllibomp.soNANA0NANA0.01NANA1NANA0.00NANA0.00NANA0.00
std::_Rb_tree_increment(std::_Rb_tree_node_base const*)libstdc++.so.6.0.29NANA0NANA0.01NANA1NANA0.00NANA0.00NANA0.00
__kmp_serialized_parallellibomp.soNANA0NANA0.01NANA1NANA0.00NANA0.00NANA0.00
std::_Rb_tree_increment(std::_Rb_tree_node_base*)libstdc++.so.6.0.29NANA0NANA0.01NANA1NANA0.00NANA0.00NANA0.00
spill_reg(sloejit::function*, std::map<sloejit::reg, sloejit::reg, std::less<sloejit::reg>, std::allocator<std::pair<sloejit::reg const, sloejit::reg> > >&, std::map<sloejit::reg, std::vector<sloejit::instruction*, std::al...libarmpl.soNANA0NANA0.01NANA1NANA0.00NANA0.00NANA0.00
mkl_dft_avx2_ownscDftInv_Prime8_32fc@pltlibmkl_avx2.so.2NA0NANA0NANA1NANANANANA0.00NANA0.00NA
__tls_get_addrld-2.28.soNA0NANA0NANA1NANANANANA0.00NANA0.00NA
acosfgmx_mpiNA0NANA0NANA1NANANANANA0.00NANA0.00NA
std::pair<std::_Rb_tree_iterator<std::pair<int const, sloejit::block_live_matrix> >, bool> std::_Rb_tree<int, std::pair<int const, sloejit::block_live_matrix>, std::_Select1st<std::pair<int const, sloejit::block_live_matrix...libarmpl.soNANA0NANA0.01NANA1NANA0.00NANA0.00NANA0.00
cosgmx_mpiNA0NANA0NANA1NANANANANA0.00NANA0.00NA
pthread_selflibpthread-2.28.soNA0NANA0NANA1NANANANANA0.00NANA0.00NA
logfgmx_mpiNA0NANA0NANA1NANANANANA0.00NANA0.00NA
sloejit::instruction::narrow_output_active_mask(sloejit::regset const&)libarmpl.soNANA0NANA0.01NANA1NANA0.00NANA0.00NANA0.00
armpl::wfta::ir_builder::build_gep(armpl::wfta::ir_value_impl*, armpl::wfta::ir_value_impl*)libarmpl.soNANA0NANA0NANA1NANANANANA0.00NANA0.00
armpl::wfta::ir_value_scope::erase_ir_value(int)libarmpl.soNANA0NANA0.01NANA1NANA0.00NANA0.00NANA0.00
gmx::invertBoxMatrix(float const (*) [3], float (*) [3])libgromacs_mpi.so.7NANA0NANA0NANA1NANANANANA0.00NANA0.00
gmx::ThreadForceBuffer<float [4]>::processMask()libgromacs_mpi.so.7NANA0NANA0NANA1NANANANANA0.00NANA0.00
ebin_increase_count(int, t_ebin*, bool)libgromacs_mpi.so.7NANA0NANA0NANA1NANANANANA0.00NANA0.00
xdr_vectorlibc-2.31.soNANA0NANA0NANA1NANANANANA0.00NANA0.00
std::pair<std::_Rb_tree_iterator<std::pair<int const, armpl::wfta::regmap_elem> >, bool> std::_Rb_tree<int, std::pair<int const, armpl::wfta::regmap_elem>, std::_Select1st<std::pair<int const, armpl::wfta::regmap_elem> &...libarmpl.soNANA0NANA0NANA1NANANANANA0.00NANA0.00
.omp_outlined.libgromacs_mpi.so.7NANA0NANA0NANA1NANANANANA0.00NANA0.00
explicit_bzerolibc-2.31.soNANA0NANA0NANA1NANANANANA0.00NANA0.00
.omp_outlined..21#0x895194libgromacs_mpi.so.7NANA0NANA0NANA1NANANANANA0.00NANA0.00
gmx_get_stop_condition()libgromacs_mpi.so.7NANA0NANA0NANA1NANANANANA0.00NANA0.00
armpl::wfta::ir_value_scope_any_order_iterator::ir_value_scope_any_order_iterator(armpl::wfta::ir_value_scope*, std::vector<armpl::wfta::ir_value_impl*, std::allocator<armpl::wfta::ir_value_impl*> >)libarmpl.soNANA0NANA0NANA1NANANANANA0.00NANA0.00
.omp_outlined..28libgromacs_mpi.so.7NANA0NANA0NANA1NANANANANA0.00NANA0.00
armpl::wfta::ir_value_scope_in_order_iterator::ir_value_scope_in_order_iterator(armpl::wfta::ir_value_scope*, std::vector<armpl::wfta::ir_value_impl*, std::allocator<armpl::wfta::ir_value_impl*> >, bool)libarmpl.soNANA0NANA0NANA1NANANANANA0.00NANA0.00
fftwf_execute_dft_r2clibarmpl.soNANA0NANA0NANA1NANANANANA0.00NANA0.00
__libm_cos_l9gmx_mpiNA0NANA0NANA1NANANANANA0.00NANA0.00NA
std::_Rb_tree<armpl::wfta::ir_value_impl*, armpl::wfta::ir_value_impl*, std::_Identity<armpl::wfta::ir_value_impl*>, std::less<armpl::wfta::ir_value_impl*>, std::allocator<armpl::wfta::ir_value_impl*> >::_M_erase(std::_Rb_tree_node&...libarmpl.soNANA0NANA0NANA1NANANANANA0.00NANA0.00
std::_Rb_tree_rebalance_for_erase(std::_Rb_tree_node_base*, std::_Rb_tree_node_base&)libstdc++.so.6.0.29NANA0NANA0NANA1NANANANANA0.00NANA0.00
std::_Rb_tree_decrement(std::_Rb_tree_node_base*)libstdc++.so.6.0.29NANA0NANA0NANA1NANANANANA0.00NANA0.00
__printf_fplibc-2.31.soNANA0NANA0NANA1NANANANANA0.00NANA0.00
operator new(unsigned long)libstdc++.so.6.0.29NANA0NANA0NANA1NANANANANA0.00NANA0.00
getenvlibc-2.31.soNANA0NANA0NANA1NANANANANA0.00NANA0.00
@plt_start@libamath_aarch64.soNANA0NANA0NANA1NANANANANA0.00NANA0.00
___kmp_freelibomp.soNANA0NANA0NANA1NANANANANA0.00NANA0.00
std::_Rb_tree_decrement(std::_Rb_tree_node_base const*)libstdc++.so.6.0.29NANA0NANA0NANA1NANANANANA0.00NANA0.00
__kmp_get_global_thread_id_reglibomp.soNANA0NANA0NANA1NANANANANA0.00NANA0.00
__kmp_join_calllibomp.soNANA0NANA0NANA1NANANANANA0.00NANA0.00
__libc_freelibc-2.31.soNANA0NANA0NANA1NANANANANA0.00NANA0.00
_IO_padnlibc-2.31.soNANA0NANA0NANA1NANANANANA0.00NANA0.00
std::locale::id::_M_id() constlibstdc++.so.6.0.29NANA0NANA0NANA1NANANANANA0.00NANA0.00
gmx_omp_get_thread_num()libgromacs_mpi.so.7NANA0NANA0NANA1NANANANANA0.00NANA0.00
_IO_file_xsputnlibc-2.31.soNANA0NANA0NANA1NANANANANA0.00NANA0.00
armpl::wfta::ir_value_scope::begin_any_order()libarmpl.soNANA0NANA0.01NANA1NANA0.00NANA0.00NANA0.00
std::_Rb_tree<armpl::wfta::ir_value_scope_iterator*, armpl::wfta::ir_value_scope_iterator*, std::_Identity<armpl::wfta::ir_value_scope_iterator*>, std::less<armpl::wfta::ir_value_scope_iterator*>, std::allocator<armpl::wfta::ir_value_scop...libarmpl.soNANA0NANA0NANA1NANANANANA0.00NANA0.00
std::map<armpl::wfta::atom, armpl::wfta::ir_value_impl*, std::less<armpl::wfta::atom>, std::allocator<std::pair<armpl::wfta::atom const, armpl::wfta::ir_value_impl*> > >::operator[](armpl::wfta::atom const&)libarmpl.soNANA0NANA0NANA1NANANANANA0.00NANA0.00
__kmpc_end_serialized_parallellibomp.soNANA0NANA0.01NANA1NANA0.00NANA0.00NANA0.00
__kmp_barrierlibomp.soNANA0NANA0.01NANA1NANA0.00NANA0.00NANA0.00
z_(armpl::wfta::ir_value_scope*, sloejit::aarch64::instr_builder&, std::vector<armpl::wfta::rodata_info, std::allocator<armpl::wfta::rodata_info> >&, std::vector<unsigned char, std::allocator<unsigned char> >&, std::map&...libarmpl.soNANA0NANA0.01NANA1NANA0.00NANA0.00NANA0.00
__memcpylibastring_aarch64.soNANA0NANA0.01NANA1NANA0.00NANA0.00NANA0.00
std::_Rb_tree<armpl::wfta::atom, std::pair<armpl::wfta::atom const, armpl::wfta::atom>, std::_Select1st<std::pair<armpl::wfta::atom const, armpl::wfta::atom> >, std::less<armpl::wfta::atom>, std::allocator<std::pair<armpl::...libarmpl.soNANA0NANA0NANA1NANANANANA0.00NANA0.00
x_(sloejit::aarch64::instr_builder&, std::map<int, armpl::wfta::regmap_elem, std::less<int>, std::allocator<std::pair<int const, armpl::wfta::regmap_elem> > >&, armpl::wfta::ir_value_impl*)libarmpl.soNANA0NANA0NANA1NANANANANA0.00NANA0.00
std::_Rb_tree<armpl::wfta::atom, std::pair<armpl::wfta::atom const, armpl::wfta::atom>, std::_Select1st<std::pair<armpl::wfta::atom const, armpl::wfta::atom> >, std::less<armpl::wfta::atom>, std::allocator<std::pair<armpl::...libarmpl.soNANA0NANA0NANA1NANANANANA0.00NANA0.00
.omp_outlined.#0x923d34libgromacs_mpi.so.7NANA0NANA0.01NANA1NANA0.00NANA0.00NANA0.00
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.7NANA0NANA0.01NANA1NANA0.00NANA0.00NANA0.00
armpl::wfta::type_check(std::__cxx11::list<armpl::wfta::expr, std::allocator<armpl::wfta::expr> >&, armpl::wfta::io_pointers const&, armpl::wfta::expr_type, armpl::wfta::expr_type)libarmpl.soNANA0NANA0.01NANA1NANA0.00NANA0.00NANA0.00
dd_move_x_constraints(gmx_domdec_t*, float const (*) [3], gmx::ArrayRef<gmx::BasicVector<float> >, gmx::ArrayRef<gmx::BasicVector<float> >, bool)libgromacs_mpi.so.7NANA0NANA0.01NANA1NANA0.00NANA0.00NANA0.00
sloejit::regset::regset<sloejit::regset_one_space_iterator, void>(sloejit::regset_one_space_iterator, sloejit::regset_one_space_iterator)libarmpl.soNANA0NANA0.01NANA1NANA0.00NANA0.00NANA0.00
set_strata_max(armpl::wfta::ir_value_impl*, int) [clone .43] [clone .extracted]libarmpl.soNANA0NANA0.01NANA1NANA0.00NANA0.00NANA0.00
armpl::wfta::do_hoist(armpl::wfta::ir_value_scope*)libarmpl.soNANA0NANA0.01NANA1NANA0.00NANA0.00NANA0.00
armpl::wfta::expr::print(armpl::wfta::ir_builder&, armpl::wfta::target const&, std::map<std::__cxx11::basic_string<char, std::char_traits<char>, std::allocator<char> >, armpl::wfta::ir_value_impl*, std::less<std::__cxx11::ba...libarmpl.soNANA0NANA0NANA1NANANANANA0.00NANA0.00
sloejit::instruction::input_regs_exact() constlibarmpl.soNANA0NANA0NANA1NANANANANA0.00NANA0.00
sloejit::instruction::erase_output_regs_wide(sloejit::regset&) constlibarmpl.soNANA0NANA0NANA1NANANANANA0.00NANA0.00
std::_Rb_tree_node<std::pair<sloejit::block* const, sloejit::live_range> >* std::_Rb_tree<sloejit::block*, std::pair<sloejit::block* const, sloejit::live_range>, std::_Select1st<std::pair<sloejit::block* const, sloejit::live_rang...libarmpl.soNANA0NANA0NANA1NANANANANA0.00NANA0.00
std::map<armpl::wfta::atom, armpl::wfta::expr_type, std::less<armpl::wfta::atom>, std::allocator<std::pair<armpl::wfta::atom const, armpl::wfta::expr_type> > >::operator[](armpl::wfta::atom const&)libarmpl.soNANA0NANA0NANA1NANANANANA0.00NANA0.00
sloejit::small_vector<sloejit::interval, 2ul>::push_back(sloejit::interval)libarmpl.soNANA0NANA0NANA1NANANANANA0.00NANA0.00
aarch64_regs_for_space(unsigned long)libarmpl.soNANA0NANA0NANA1NANANANANA0.00NANA0.00
sloejit::live_matrix::at(sloejit::reg) constlibarmpl.soNANA0NANA0NANA1NANANANANA0.00NANA0.00
sloejit::instruction::output_regs_exact() constlibarmpl.soNANA0NANA0NANA1NANANANANA0.00NANA0.00
std::_Rb_tree<armpl::wfta::atom, std::pair<armpl::wfta::atom const, armpl::wfta::expr_type>, std::_Select1st<std::pair<armpl::wfta::atom const, armpl::wfta::expr_type> >, std::less<armpl::wfta::atom>, std::allocator<std::pair&...libarmpl.soNANA0NANA0NANA1NANANANANA0.00NANA0.00
armpl::wfta::ir_value_function::make_root_scope()libarmpl.soNANA0NANA0NANA1NANANANANA0.00NANA0.00
std::_Rb_tree<sloejit::reg, std::pair<sloejit::reg const, std::map<double, sloejit::live_position_elem, std::less<double>, std::allocator<std::pair<double const, sloejit::live_position_elem> > > >, std::_Select1st<std::p...libarmpl.soNANA0NANA0NANA1NANANANANA0.00NANA0.00
armpl::wfta::ir_value_scope::begin_in_rev_order()libarmpl.soNANA0NANA0NANA1NANANANANA0.00NANA0.00
apply_subs(sloejit::regset&, std::map<sloejit::reg, unsigned char, std::less<sloejit::reg>, std::allocator<std::pair<sloejit::reg const, unsigned char> > > const&)libarmpl.soNANA0NANA0NANA1NANANANANA0.00NANA0.00
std::pair<std::_Rb_tree_iterator<std::pair<int const, std::unique_ptr<armpl::wfta::ir_value_impl, std::default_delete<armpl::wfta::ir_value_impl> > > >, bool> std::_Rb_tree<int, std::pair<int const, std::unique_ptr<ar...libarmpl.soNANA0NANA0NANA1NANANANANA0.00NANA0.00
sloejit::block::substitute_constraint_set(sloejit::regmap<sloejit::reg> const&)libarmpl.soNANA0NANA0NANA1NANANANANA0.00NANA0.00
mkl_dft_avx2_ippsFFTInv_CCSToR_32f@pltlibmkl_avx2.so.2NA0NANA0NANA1NANANANANA0.00NANA0.00NA
mkl_dft_avx2_transfer_ipp_mkl_errorlibmkl_avx2.so.2NA0NANA0NANA1NANANANANA0.00NANA0.00NA
mkl_dft_avx2_ippsFFTFwd_RToPerm_32f@pltlibmkl_avx2.so.2NA0NANA0NANA1NANANANANA0.00NANA0.00NA
gmx::InMemoryDeserializer::doRvec(float (*) [3])libgromacs_mpi.so.70NANA0NANA1NANANANANA0.00NANA0.00NANA
__pthread_getspecificlibc.so.60NANA0NANA1NANANANANA0.00NANA0.00NANA
btowclibc.so.60NANA0NANA1NANANANANA0.00NANA0.00NANA
gmx::InMemoryDeserializer::doInt(int*)libgromacs_mpi.so.700NA00NA11NANANANA0.000.00NA0.000.00NA
expgmx_mpi00NA00NA11NANANANA0.000.00NA0.000.00NA
gmx::InMemorySerializer::doInt(int*)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.7000000.01111NANA0.000.000.000.000.000.000.00
reduceForces(nbnxn_atomdata_t*, gmx::AtomLocality, Nbnxm::GridSet const&, float (*) [3])libgromacs_mpi.so.70NANA0NANA1NANANANANA0.00NANA0.00NANA
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.700NA00NA11NANANANA0.000.00NA0.000.00NA
dd_clear_local_constraint_indices(gmx_domdec_t*)libgromacs_mpi.so.70NANA0NANA1NANANANANA0.00NANA0.00NANA
__kmpc_end_serialized_parallellibiomp5.so00NA00.01NA11NANA5.63NA0.000.00NA0.000.00NA
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.7000000111NANANA0.000.000.000.000.000.00
std::_Rb_tree<std::__cxx11::basic_string<char, std::char_traits<char>, std::allocator<char> >, std::pair<std::__cxx11::basic_string<char, std::char_traits<char>, std::allocator<char> > const, std::unique_ptr<gmx...libgromacs_mpi.so.70NANA0NANA1NANANANANA0.00NANA0.00NANA
dd_collect_vec(gmx_domdec_t*, int, int, gmx::ArrayRef<int const>, gmx::ArrayRef<gmx::BasicVector<float> const>, gmx::ArrayRef<gmx::BasicVector<float> >)libgromacs_mpi.so.70NANA0NANA1NANANANANA0.00NANA0.00NANA
make_local_bondeds_excls(gmx_domdec_t const&, gmx_domdec_zones_t const&, gmx_mtop_t const&, gmx::ArrayRef<long const>, bool, int const*, bool, float, t_pbc const*, gmx::ArrayRef<gmx::BasicVector<float> const>, InteractionDefin...libgromacs_mpi.so.70NANA0NANA1NANANANANA0.00NANA0.00NANA
void doStopComMotionLinear<3>(t_mdatoms const&, gmx::ArrayRef<gmx::BasicVector<float> >, t_vcm const&)libgromacs_mpi.so.700NA00NA11NANANANA0.000.00NA0.000.00NA
_itoa_wordlibc-2.28.soNA0NANA0.01NANA1NANA0.00NANA0.00NANA0.00NA
gmx::Update::deform() constlibgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
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.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
gmx_omp_nthreads_get(ModuleMultiThread)libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
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.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
reset_enerdata(gmx_enerdata_t*)libgromacs_mpi.so.7NA00NA00NA11NANANANA0.000.00NA0.000.00
low_set_pbc(t_pbc*, PbcType, int const*, float const (*) [3])libgromacs_mpi.so.700NA00NA11NANANANA0.000.00NA0.000.00NA
nrnbIndex(int)libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
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.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
mkl_dft_avx2_ownscDftInv_Fact3_32fc@pltlibmkl_avx2.so.2NA0NANA0.01NANA1NANA5.00NANA0.00NANA0.00NA
ewald_charge_correction(t_commrec const*, float, float, gmx::ArrayRef<double const>, float, float const (*) [3], float*, float (*) [3])libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
@plt_start@libstdc++.so.6.0.29NANA0NANA0NANA1NANANANANA0.00NANA0.00
gmx_parallel_3dfft_complex_limits(gmx_parallel_3dfft*, int*, int*, int*, int*)libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
gmx::HostAllocationPolicy::HostAllocationPolicy(gmx::PinningPolicy)libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
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.7NA00NA00NA11NANANANA0.000.00NA0.000.00
gmx_reverse_top_t::interactionListForMoleculeType(int) constlibgromacs_mpi.so.70NANA0NANA1NANANANANA0.00NANA0.00NANA
shift_x(t_graph const*, float const (*) [3], float const (*) [3], float (*) [3])libgromacs_mpi.so.70NA00NA01NA1NANANA0.00NA0.000.00NA0.00
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.70000.01001110.00NANA0.000.000.000.000.000.00
gmx::set_lincs_matrix(gmx::Lincs*, gmx::ArrayRef<float const>, float)libgromacs_mpi.so.700NA0.010NA11NA0.00NANA0.000.00NA0.000.00NA
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.700NA0.010NA11NA0.00NANA0.000.00NA0.000.00NA
inflate_fastlibmpi.so.12.0.00NANA0.01NANA1NANA0.00NANA0.00NANA0.00NANA
gmx_reverse_top_t::hasPositionRestraints() constlibgromacs_mpi.so.70000.01001110.00NANA0.000.000.000.000.000.00
getGroupType(SimulationGroups const&, SimulationAtomGroupType, int)libgromacs_mpi.so.700NA0.010.01NA11NA0.000.00NA0.000.00NA0.000.00NA
make_dd_indices(gmx_domdec_t*, int)libgromacs_mpi.so.70000.01001110.00NANA0.000.000.000.000.000.00
gmx_parallel_3dfft_real_limits(gmx_parallel_3dfft*, int*, int*, int*)libgromacs_mpi.so.700NA0.010NA11NA0.00NANA0.000.00NA0.000.00NA
erfcfgmx_mpi00NA0.010NA11NA5.00NANA0.000.00NA0.000.00NA
gmx::LegacySimulator::do_md()libgromacs_mpi.so.70000.01001110.00NANA0.000.000.000.000.000.00
_dl_rtld_di_serinfold-linux-x86-64.so.20NANA0.01NANA1NANA0.00NANA0.00NANA0.00NANA
gmx::set_lincs(InteractionDefinitions const&, int, gmx::ArrayRef<float const>, float, bool, t_commrec const*, gmx::Lincs*)libgromacs_mpi.so.70NA00.01NA0.011NA10.00NA0.000.00NA0.000.00NA0.00
_IO_fwritelibc.so.60NANA0.01NANA1NANA0.00NANA0.00NANA0.00NANA
nbnxn_atomdata_copy_x_to_nbat_x(Nbnxm::GridSet const&, gmx::AtomLocality, float const (*) [3], nbnxn_atomdata_t*) [clone .extracted]libgromacs_mpi.so.700NA0.010.01NA11NA0.000.00NA0.000.00NA0.000.00NA
dd_make_reverse_top(_IO_FILE*, gmx_domdec_t*, gmx_mtop_t const&, gmx::VirtualSitesHandler const*, t_inputrec const&, gmx::DDBondedChecking)libgromacs_mpi.so.70NANA0NANA1NANANANANA0.00NANA0.00NANA
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.70NANA0.01NANA1NANA0.00NANA0.00NANA0.00NANA
mkl_dft_avx512_transfer_ipp_mkl_error@pltlibmkl_avx512.so.20NANA0.01NANA1NANA112.00NANA0.00NANA0.00NANA
update_pcouple_before_coordinates(_IO_FILE*, long, t_inputrec const*, t_state*, float (*) [3], float (*) [3], bool)libgromacs_mpi.so.70NANA0NANA1NANANANANA0.00NANA0.00NANA
add_ebin_indexed(t_ebin*, int, gmx::ArrayRef<bool>, gmx::ArrayRef<float const>, bool)libgromacs_mpi.so.70NANA0NANA1NANANANANA0.00NANA0.00NANA
MPIDIG_am_comm_abort_initlibmpi.so.12.0.00NANA0NANA1NANANANANA0.00NANA0.00NANA
_strnlen_s_chklibiomp5.so0NANA0NANA1NANANANANA0.00NANA0.00NANA
AtomProxy::residueName() constlibgromacs_mpi.so.70NANA0NANA1NANANANANA0.00NANA0.00NANA
__intel_rtdd_indepgmx_mpi0NANA0.01NANA1NANA0.00NANA0.00NANA0.00NANA
gmx::SettleData::setConstraints(InteractionList const&, int, gmx::ArrayRef<float const>, gmx::ArrayRef<float const>)libgromacs_mpi.so.70NANA0NANA1NANANANANA0.00NANA0.00NANA
gmx::Update::Impl::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.70NANA0NANA1NANANANANA0.00NANA0.00NANA
expfgmx_mpi00NA0.010NA11NA2.00NANA0.000.00NA0.000.00NA
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.700000.010.01111NA0.380.000.000.000.000.000.000.00
pme_run_mode(gmx_pme_t const*)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.70NANA0NANA1NANANANANA0.00NANA0.00NANA
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.700NA00NA11NANANANA0.000.00NA0.000.00NA
mkl_dft_avx2_ownscDftFwd_Prime8_32fc@pltlibmkl_avx2.so.2NA0NANA0NANA1NANANANANA0.00NANA0.00NA
gmx::constrain_coordinates(gmx::Constraints*, bool, bool, long, t_state*, gmx::ArrayRefWithPadding<gmx::BasicVector<float> >, float*, bool, float (*) [3])libgromacs_mpi.so.7NA00NA00NA11NANANANA0.000.00NA0.000.00
_intel_fast_memsetlibiomp5.soNA0NANA0NANA1NANANANANA0.00NANA0.00NA
mkl_dft_avx2_owns_cRealRecombine_32f@pltlibmkl_avx2.so.2NA0NANA0NANA1NANANANANA0.00NANA0.00NA
scalable_aligned_malloclibiomp5.soNA0NANA0NANA1NANANANANA0.00NANA0.00NA
scalable_aligned_freelibiomp5.soNA0NANA0NANA1NANANANANA0.00NANA0.00NA
mkl_dft_avx2_ownscDftInv_Fact4_32fc@pltlibmkl_avx2.so.2NA0NANA0NANA1NANANANANA0.00NANA0.00NA
make_tables(_IO_FILE*, interaction_const_t const*, char const*, float, int)libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
wallcycleBarrier(gmx_wallcycle*)libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
set_pbc_simd(t_pbc const*, float*)libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
.plt.got@startlibmkl_avx2.so.2NA0NANA0NANA1NANANANANA0.00NANA0.00NA
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.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
gmx::SimulationSignaller::getCommunicationBuffer()libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
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.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
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.7NA00NA00NA11NANANANA0.000.00NA0.000.00
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.7NA00NA00NA11NANANANA0.000.00NA0.000.00
gmx::makeLincsDeviations(gmx::Lincs const&, gmx::ArrayRef<gmx::BasicVector<float> const>, t_pbc const*)libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
gmx::Update::xp()libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
shift_self(t_graph const&, float const (*) [3], float (*) [3])libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
mkl_dft_avx2_ownscDftFwd_Fact3_32fc@pltlibmkl_avx2.so.2NA0NANA0NANA1NANANANANA0.00NANA0.00NA
__kmpc_fork_calllibiomp5.soNA0NANA0NANA1NANANANANA0.00NANA0.00NA
__kmpc_barrierlibiomp5.soNA0NANA0NANA1NANANANANA0.00NANA0.00NA
__kmpc_push_num_threadslibiomp5.soNA0NANA0NANA1NANANANANA0.00NANA0.00NA
mkl_dft_avx2_ownscDftFwd_Fact4_32fc@pltlibmkl_avx2.so.2NA0NANA0NANA1NANANANANA0.00NANA0.00NA
mkl_dft_avx2_owns_cCcsRecombine_32f@pltlibmkl_avx2.so.2NA0NANA0NANA1NANANANANA0.00NANA0.00NA
__kmp_pop_current_task_from_threadlibiomp5.soNA0NANA0NANA1NANANANANA0.00NANA0.00NA
__kmpc_for_static_finilibiomp5.soNA0NANA0NANA1NANANANANA0.00NANA0.00NA
mkl_dft_avx2_transfer_ipp_mkl_error@pltlibmkl_avx2.so.2NA0NANA0NANA1NANANANANA0.00NANA0.00NA
__kmp_join_calllibiomp5.soNA0NANA0NANA1NANANANANA0.00NANA0.00NA
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.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
__kmp_fork_calllibiomp5.soNA0NANA0NANA1NANANANANA0.00NANA0.00NA
__kmp_get_global_thread_id_reglibiomp5.soNA0NANA0NANA1NANANANANA0.00NANA0.00NA
__kmp_serialized_parallellibiomp5.soNA0NANA0NANA1NANANANANA0.00NANA0.00NA
minCellSizeForAtomDisplacement(gmx_mtop_t const&, t_inputrec const&, gmx::ArrayRef<gmx::RangePartitioning const>, float, ChanceTarget)libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
ListedForces::haveCpuListedForces(t_fcdata const&) constlibgromacs_mpi.so.7NA00NA00NA11NANANANA0.000.00NA0.000.00
(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.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
gmx_reverse_top_t::hasIntermolecularInteractions() constlibgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
mkl_dft_avx2_ownscDftFwd_PrimeFact_32fc@pltlibmkl_avx2.so.2NA0NANA0NANA1NANANANANA0.00NANA0.00NA
dd_move_x_specat(gmx_domdec_t const*, gmx_domdec_specat_comm_t*, float const (*) [3], float (*) [3], float (*) [3], bool)libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
__kmp_barrierlibiomp5.soNA0NANA0NANA1NANANANANA0.00NANA0.00NA
Nbnxm::GridSet::setLocalAtomOrder()libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
malloc_consolidatelibc-2.28.soNA0NANA0NANA1NANANANANA0.00NANA0.00NA
AtomIterator::operator++()libgromacs_mpi.so.7NA00NA00NA11NANANANA0.000.00NA0.000.00
__GI__dl_addrlibc-2.28.soNA0NANA0NANA1NANANANANA0.00NANA0.00NA
__memset_avx2_unaligned_ermslibc-2.28.soNA0NANA0NANA1NANANANANA0.00NANA0.00NA
_INTERNALbe3edb14::rml::internal::internalPoolMalloc(_INTERNALbe3edb14::rml::internal::MemoryPool*, unsigned long)libiomp5.soNA0NANA0NANA1NANANANANA0.00NANA0.00NA
__strnlen_avx2libc-2.28.soNA0NANA0NANA1NANANANANA0.00NANA0.00NA
__strncmp_avx2libc-2.28.soNA0NANA0NANA1NANANANANA0.00NANA0.00NA
__strchrnul_avx2libc-2.28.soNA0NANA0NANA1NANANANANA0.00NANA0.00NA
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.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
_IO_padnlibc-2.28.soNA0NANA0NANA1NANANANANA0.00NANA0.00NA
__GI___printf_fplibc-2.28.soNA0NANA0NANA1NANANANANA0.00NANA0.00NA
do_lookup_xld-2.28.soNA0NANA0NANA1NANANANANA0.00NANA0.00NA
_dl_lookup_symbol_xld-2.28.soNA0NANA0NANA1NANANANANA0.00NANA0.00NA
gmx_parallel_3dfft_execute(gmx_parallel_3dfft*, gmx_fft_direction, int, gmx_wallcycle*)libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
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.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
spread_on_grid(gmx_pme_t const*, PmeAtomComm*, pmegrids_t const*, bool, bool, float*, bool, int)libgromacs_mpi.so.7NA0NANA0NANA1NANANANANA0.00NANA0.00NA
_IO_vfscanflibc-2.28.soNA0NANA0NANA1NANANANANA0.00NANA0.00NA
sincosfgmx_mpiNA0NANA0NANA1NANANANANA0.00NANA0.00NA
__GI___pthread_getspecificlibpthread-2.28.soNA0NANA0NANA1NANANANANA0.00NANA0.00NA
__mpn_mul_1libc-2.28.soNA0NANA0NANA1NANANANANA0.00NANA0.00NA
__libm_erf_exgmx_mpiNA0NANA0NANA1NANANANANA0.00NANA0.00NA
__mpn_divremlibc-2.28.soNA0NANA0NANA1NANANANANA0.00NANA0.00NA
__libm_logf_l9gmx_mpiNA0NANA0NANA1NANANANANA0.00NANA0.00NA
_intel_fast_memsetgmx_mpiNA0NANA0NANA1NANANANANA0.00NANA0.00NA
Unknown functionld-2.31.soNANA0NANA0NANA1NANANANANA0.00NANA0.00
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