pbc_dx_aiuc(t_pbc const*, float const*, float const*, float*) - Load Distribution

pbc_dx_aiuc(t_pbc const*, float const*, float const*, float*) - Sorted Load Distribution

pbc_dx_aiuc(t_pbc const*, float const*, float const*, float*) - Load Distribution All Threads

pbc_dx_aiuc(t_pbc const*, float const*, float const*, float*)

Columns Filter

(1x1) Efficiency (1x1) Potential Speed-Up (%) (2x1) Efficiency (2x1) Potential Speed-Up (%) (4x1) Efficiency (4x1) Potential Speed-Up (%) (8x1) Efficiency (8x1) Potential Speed-Up (%) (16x1) Efficiency (16x1) Potential Speed-Up (%) (32x1) Efficiency (32x1) Potential Speed-Up (%) (64x1) Efficiency (64x1) Potential Speed-Up (%) (128x1) Efficiency (128x1) Potential Speed-Up (%) (192x1) Efficiency (192x1) Potential Speed-Up (%)
(1x1) Efficiency(1x1) Potential Speed-Up (%)(2x1) Efficiency(2x1) Potential Speed-Up (%)(4x1) Efficiency(4x1) Potential Speed-Up (%)(8x1) Efficiency(8x1) Potential Speed-Up (%)(16x1) Efficiency(16x1) Potential Speed-Up (%)(32x1) Efficiency(32x1) Potential Speed-Up (%)(64x1) Efficiency(64x1) Potential Speed-Up (%)(128x1) Efficiency(128x1) Potential Speed-Up (%)(192x1) Efficiency(192x1) Potential Speed-Up (%)
100.9901.0601.0901.5701.5801.360

Speed-Up and Efficiency

Coverage (%)NameSource LocationModule
19.74+bond_angle(float const*, float[...]bonded.cpp:129libgromacs_mpi.so.9.0.0
std::enable_if<(((BondedKernel[...]bonded.cpp:1037libgromacs_mpi.so.9.0.0
calculateSimpleBond(int, int, [...]bonded.cpp:4143libgromacs_mpi.so.9.0.0
(anonymous namespace)::calc_on[...]listed_forces.cpp:356libgromacs_mpi.so.9.0.0
.omp_outlined.#0xbe5d40listed_forces.cpp:428libgromacs_mpi.so.9.0.0
__kmp_invoke_microtasklibomp.so
__kmp_fork_calllibomp.so
__kmpc_fork_calllibomp.so
ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
do_force(_IO_FILE*, t_commrec [...]sim_util.cpp:2047libgromacs_mpi.so.9.0.0
gmx::LegacySimulator::do_md()md.cpp:1248libgromacs_mpi.so.9.0.0
gmx::Mdrunner::mdrunner()runner.cpp:2311libgromacs_mpi.so.9.0.0
gmx::gmx_mdrun(int, gmx_hw_inf[...]mdrun.cpp:280gmx_mpi
gmx::gmx_mdrun(int, char**)mdrun.cpp:82gmx_mpi
gmx::CommandLineModuleManager:[...]cmdlinemodulemanager.cpp:569libgromacs_mpi.so.9.0.0
maingmx.cpp:58gmx_mpi
__libc_start_call_mainlibc.so.6
13.95+dih_angle(float const*, float [...]bonded.cpp:129libgromacs_mpi.so.9.0.0
std::enable_if<(((BondedKernel[...]bonded.cpp:1987libgromacs_mpi.so.9.0.0
calculateSimpleBond(int, int, [...]bonded.cpp:4143libgromacs_mpi.so.9.0.0
(anonymous namespace)::calc_on[...]listed_forces.cpp:356libgromacs_mpi.so.9.0.0
.omp_outlined.#0xbe5d40listed_forces.cpp:428libgromacs_mpi.so.9.0.0
__kmp_invoke_microtasklibomp.so
__kmp_fork_calllibomp.so
__kmpc_fork_calllibomp.so
ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
do_force(_IO_FILE*, t_commrec [...]sim_util.cpp:2047libgromacs_mpi.so.9.0.0
gmx::LegacySimulator::do_md()md.cpp:1248libgromacs_mpi.so.9.0.0
gmx::Mdrunner::mdrunner()runner.cpp:2311libgromacs_mpi.so.9.0.0
gmx::gmx_mdrun(int, gmx_hw_inf[...]mdrun.cpp:280gmx_mpi
gmx::gmx_mdrun(int, char**)mdrun.cpp:82gmx_mpi
gmx::CommandLineModuleManager:[...]cmdlinemodulemanager.cpp:569libgromacs_mpi.so.9.0.0
maingmx.cpp:58gmx_mpi
__libc_start_call_mainlibc.so.6
13.68+bond_angle(float const*, float[...]bonded.cpp:155libgromacs_mpi.so.9.0.0
std::enable_if<(((BondedKernel[...]bonded.cpp:1037libgromacs_mpi.so.9.0.0
calculateSimpleBond(int, int, [...]bonded.cpp:4143libgromacs_mpi.so.9.0.0
(anonymous namespace)::calc_on[...]listed_forces.cpp:356libgromacs_mpi.so.9.0.0
.omp_outlined.#0xbe5d40listed_forces.cpp:428libgromacs_mpi.so.9.0.0
__kmp_invoke_microtasklibomp.so
__kmp_fork_calllibomp.so
__kmpc_fork_calllibomp.so
ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
do_force(_IO_FILE*, t_commrec [...]sim_util.cpp:2047libgromacs_mpi.so.9.0.0
gmx::LegacySimulator::do_md()md.cpp:1248libgromacs_mpi.so.9.0.0
gmx::Mdrunner::mdrunner()runner.cpp:2311libgromacs_mpi.so.9.0.0
gmx::gmx_mdrun(int, gmx_hw_inf[...]mdrun.cpp:280gmx_mpi
gmx::gmx_mdrun(int, char**)mdrun.cpp:82gmx_mpi
gmx::CommandLineModuleManager:[...]cmdlinemodulemanager.cpp:569libgromacs_mpi.so.9.0.0
maingmx.cpp:58gmx_mpi
__libc_start_call_mainlibc.so.6
11.05+do_pairs(int, int, int const*,[...]pairs.cpp:664libgromacs_mpi.so.9.0.0
(anonymous namespace)::calc_on[...]listed_forces.cpp:334libgromacs_mpi.so.9.0.0
.omp_outlined.#0xbe5d40listed_forces.cpp:428libgromacs_mpi.so.9.0.0
__kmp_invoke_microtasklibomp.so
__kmp_fork_calllibomp.so
__kmpc_fork_calllibomp.so
ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
do_force(_IO_FILE*, t_commrec [...]sim_util.cpp:2047libgromacs_mpi.so.9.0.0
gmx::LegacySimulator::do_md()md.cpp:1248libgromacs_mpi.so.9.0.0
gmx::Mdrunner::mdrunner()runner.cpp:2311libgromacs_mpi.so.9.0.0
gmx::gmx_mdrun(int, gmx_hw_inf[...]mdrun.cpp:280gmx_mpi
gmx::gmx_mdrun(int, char**)mdrun.cpp:82gmx_mpi
gmx::CommandLineModuleManager:[...]cmdlinemodulemanager.cpp:569libgromacs_mpi.so.9.0.0
maingmx.cpp:58gmx_mpi
__libc_start_call_mainlibc.so.6
10.53+void do_dih_fup<(BondedKernelF[...]bonded.cpp:129libgromacs_mpi.so.9.0.0
std::enable_if<(((BondedKernel[...]bonded.cpp:2010libgromacs_mpi.so.9.0.0
calculateSimpleBond(int, int, [...]bonded.cpp:4143libgromacs_mpi.so.9.0.0
(anonymous namespace)::calc_on[...]listed_forces.cpp:356libgromacs_mpi.so.9.0.0
.omp_outlined.#0xbe5d40listed_forces.cpp:428libgromacs_mpi.so.9.0.0
__kmp_invoke_microtasklibomp.so
__kmp_fork_calllibomp.so
__kmpc_fork_calllibomp.so
ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
do_force(_IO_FILE*, t_commrec [...]sim_util.cpp:2047libgromacs_mpi.so.9.0.0
gmx::LegacySimulator::do_md()md.cpp:1248libgromacs_mpi.so.9.0.0
gmx::Mdrunner::mdrunner()runner.cpp:2311libgromacs_mpi.so.9.0.0
gmx::gmx_mdrun(int, gmx_hw_inf[...]mdrun.cpp:280gmx_mpi
gmx::gmx_mdrun(int, char**)mdrun.cpp:82gmx_mpi
gmx::CommandLineModuleManager:[...]cmdlinemodulemanager.cpp:569libgromacs_mpi.so.9.0.0
maingmx.cpp:58gmx_mpi
__libc_start_call_mainlibc.so.6
9.21+dih_angle(float const*, float [...]bonded.cpp:179libgromacs_mpi.so.9.0.0
std::enable_if<(((BondedKernel[...]bonded.cpp:1987libgromacs_mpi.so.9.0.0
calculateSimpleBond(int, int, [...]bonded.cpp:4143libgromacs_mpi.so.9.0.0
(anonymous namespace)::calc_on[...]listed_forces.cpp:356libgromacs_mpi.so.9.0.0
.omp_outlined.#0xbe5d40listed_forces.cpp:428libgromacs_mpi.so.9.0.0
__kmp_invoke_microtasklibomp.so
__kmp_fork_calllibomp.so
__kmpc_fork_calllibomp.so
ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
do_force(_IO_FILE*, t_commrec [...]sim_util.cpp:2047libgromacs_mpi.so.9.0.0
gmx::LegacySimulator::do_md()md.cpp:1248libgromacs_mpi.so.9.0.0
gmx::Mdrunner::mdrunner()runner.cpp:2311libgromacs_mpi.so.9.0.0
gmx::gmx_mdrun(int, gmx_hw_inf[...]mdrun.cpp:280gmx_mpi
gmx::gmx_mdrun(int, char**)mdrun.cpp:82gmx_mpi
gmx::CommandLineModuleManager:[...]cmdlinemodulemanager.cpp:569libgromacs_mpi.so.9.0.0
maingmx.cpp:58gmx_mpi
__libc_start_call_mainlibc.so.6
8.42+dih_angle(float const*, float [...]bonded.cpp:178libgromacs_mpi.so.9.0.0
std::enable_if<(((BondedKernel[...]bonded.cpp:1987libgromacs_mpi.so.9.0.0
calculateSimpleBond(int, int, [...]bonded.cpp:4143libgromacs_mpi.so.9.0.0
(anonymous namespace)::calc_on[...]listed_forces.cpp:356libgromacs_mpi.so.9.0.0
.omp_outlined.#0xbe5d40listed_forces.cpp:428libgromacs_mpi.so.9.0.0
__kmp_invoke_microtasklibomp.so
__kmp_fork_calllibomp.so
__kmpc_fork_calllibomp.so
ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
do_force(_IO_FILE*, t_commrec [...]sim_util.cpp:2047libgromacs_mpi.so.9.0.0
gmx::LegacySimulator::do_md()md.cpp:1248libgromacs_mpi.so.9.0.0
gmx::Mdrunner::mdrunner()runner.cpp:2311libgromacs_mpi.so.9.0.0
gmx::gmx_mdrun(int, gmx_hw_inf[...]mdrun.cpp:280gmx_mpi
gmx::gmx_mdrun(int, char**)mdrun.cpp:82gmx_mpi
gmx::CommandLineModuleManager:[...]cmdlinemodulemanager.cpp:569libgromacs_mpi.so.9.0.0
maingmx.cpp:58gmx_mpi
__libc_start_call_mainlibc.so.6
2.63+dih_angle(float const*, float [...]bonded.cpp:178libgromacs_mpi.so.9.0.0
float (anonymous namespace)::i[...]bonded.cpp:2298libgromacs_mpi.so.9.0.0
calculateSimpleBond(int, int, [...]bonded.cpp:4143libgromacs_mpi.so.9.0.0
(anonymous namespace)::calc_on[...]listed_forces.cpp:356libgromacs_mpi.so.9.0.0
.omp_outlined.#0xbe5d40listed_forces.cpp:428libgromacs_mpi.so.9.0.0
__kmp_invoke_microtasklibomp.so
__kmp_fork_calllibomp.so
__kmpc_fork_calllibomp.so
ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
do_force(_IO_FILE*, t_commrec [...]sim_util.cpp:2047libgromacs_mpi.so.9.0.0
gmx::LegacySimulator::do_md()md.cpp:1248libgromacs_mpi.so.9.0.0
gmx::Mdrunner::mdrunner()runner.cpp:2311libgromacs_mpi.so.9.0.0
gmx::gmx_mdrun(int, gmx_hw_inf[...]mdrun.cpp:280gmx_mpi
gmx::gmx_mdrun(int, char**)mdrun.cpp:82gmx_mpi
gmx::CommandLineModuleManager:[...]cmdlinemodulemanager.cpp:569libgromacs_mpi.so.9.0.0
maingmx.cpp:58gmx_mpi
__libc_start_call_mainlibc.so.6
1.58+dih_angle(float const*, float [...]bonded.cpp:178libgromacs_mpi.so.9.0.0
std::enable_if<(((BondedKernel[...]bonded.cpp:2968libgromacs_mpi.so.9.0.0
calculateSimpleBond(int, int, [...]bonded.cpp:4143libgromacs_mpi.so.9.0.0
(anonymous namespace)::calc_on[...]listed_forces.cpp:356libgromacs_mpi.so.9.0.0
.omp_outlined.#0xbe5d40listed_forces.cpp:428libgromacs_mpi.so.9.0.0
__kmp_invoke_microtasklibomp.so
__kmp_fork_calllibomp.so
__kmpc_fork_calllibomp.so
ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
do_force(_IO_FILE*, t_commrec [...]sim_util.cpp:2047libgromacs_mpi.so.9.0.0
gmx::LegacySimulator::do_md()md.cpp:1248libgromacs_mpi.so.9.0.0
gmx::Mdrunner::mdrunner()runner.cpp:2311libgromacs_mpi.so.9.0.0
gmx::gmx_mdrun(int, gmx_hw_inf[...]mdrun.cpp:280gmx_mpi
gmx::gmx_mdrun(int, char**)mdrun.cpp:82gmx_mpi
gmx::CommandLineModuleManager:[...]cmdlinemodulemanager.cpp:569libgromacs_mpi.so.9.0.0
maingmx.cpp:58gmx_mpi
__libc_start_call_mainlibc.so.6
1.58+dih_angle(float const*, float [...]bonded.cpp:179libgromacs_mpi.so.9.0.0
float (anonymous namespace)::i[...]bonded.cpp:2298libgromacs_mpi.so.9.0.0
calculateSimpleBond(int, int, [...]bonded.cpp:4143libgromacs_mpi.so.9.0.0
(anonymous namespace)::calc_on[...]listed_forces.cpp:356libgromacs_mpi.so.9.0.0
.omp_outlined.#0xbe5d40listed_forces.cpp:428libgromacs_mpi.so.9.0.0
__kmp_invoke_microtasklibomp.so
__kmp_fork_calllibomp.so
__kmpc_fork_calllibomp.so
ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
do_force(_IO_FILE*, t_commrec [...]sim_util.cpp:2047libgromacs_mpi.so.9.0.0
gmx::LegacySimulator::do_md()md.cpp:1248libgromacs_mpi.so.9.0.0
gmx::Mdrunner::mdrunner()runner.cpp:2311libgromacs_mpi.so.9.0.0
gmx::gmx_mdrun(int, gmx_hw_inf[...]mdrun.cpp:280gmx_mpi
gmx::gmx_mdrun(int, char**)mdrun.cpp:82gmx_mpi
gmx::CommandLineModuleManager:[...]cmdlinemodulemanager.cpp:569libgromacs_mpi.so.9.0.0
maingmx.cpp:58gmx_mpi
__libc_start_call_mainlibc.so.6
1.32+dih_angle(float const*, float [...]bonded.cpp:129libgromacs_mpi.so.9.0.0
float (anonymous namespace)::i[...]bonded.cpp:2298libgromacs_mpi.so.9.0.0
calculateSimpleBond(int, int, [...]bonded.cpp:4143libgromacs_mpi.so.9.0.0
(anonymous namespace)::calc_on[...]listed_forces.cpp:356libgromacs_mpi.so.9.0.0
.omp_outlined.#0xbe5d40listed_forces.cpp:428libgromacs_mpi.so.9.0.0
__kmp_invoke_microtasklibomp.so
__kmp_fork_calllibomp.so
__kmpc_fork_calllibomp.so
ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
do_force(_IO_FILE*, t_commrec [...]sim_util.cpp:2047libgromacs_mpi.so.9.0.0
gmx::LegacySimulator::do_md()md.cpp:1248libgromacs_mpi.so.9.0.0
gmx::Mdrunner::mdrunner()runner.cpp:2311libgromacs_mpi.so.9.0.0
gmx::gmx_mdrun(int, gmx_hw_inf[...]mdrun.cpp:280gmx_mpi
gmx::gmx_mdrun(int, char**)mdrun.cpp:82gmx_mpi
gmx::CommandLineModuleManager:[...]cmdlinemodulemanager.cpp:569libgromacs_mpi.so.9.0.0
maingmx.cpp:58gmx_mpi
__libc_start_call_mainlibc.so.6
1.32+std::enable_if<(((BondedKernel[...]bonded.cpp:1987libgromacs_mpi.so.9.0.0
calculateSimpleBond(int, int, [...]bonded.cpp:4143libgromacs_mpi.so.9.0.0
(anonymous namespace)::calc_on[...]listed_forces.cpp:356libgromacs_mpi.so.9.0.0
.omp_outlined.#0xbe5d40listed_forces.cpp:428libgromacs_mpi.so.9.0.0
__kmp_invoke_microtasklibomp.so
__kmp_fork_calllibomp.so
__kmpc_fork_calllibomp.so
ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
do_force(_IO_FILE*, t_commrec [...]sim_util.cpp:2047libgromacs_mpi.so.9.0.0
gmx::LegacySimulator::do_md()md.cpp:1248libgromacs_mpi.so.9.0.0
gmx::Mdrunner::mdrunner()runner.cpp:2311libgromacs_mpi.so.9.0.0
gmx::gmx_mdrun(int, gmx_hw_inf[...]mdrun.cpp:280gmx_mpi
gmx::gmx_mdrun(int, char**)mdrun.cpp:82gmx_mpi
gmx::CommandLineModuleManager:[...]cmdlinemodulemanager.cpp:569libgromacs_mpi.so.9.0.0
maingmx.cpp:58gmx_mpi
__libc_start_call_mainlibc.so.6
1.05+std::enable_if<(((BondedKernel[...]bonded.cpp:1037libgromacs_mpi.so.9.0.0
calculateSimpleBond(int, int, [...]bonded.cpp:4143libgromacs_mpi.so.9.0.0
(anonymous namespace)::calc_on[...]listed_forces.cpp:356libgromacs_mpi.so.9.0.0
.omp_outlined.#0xbe5d40listed_forces.cpp:428libgromacs_mpi.so.9.0.0
__kmp_invoke_microtasklibomp.so
__kmp_fork_calllibomp.so
__kmpc_fork_calllibomp.so
ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
do_force(_IO_FILE*, t_commrec [...]sim_util.cpp:2047libgromacs_mpi.so.9.0.0
gmx::LegacySimulator::do_md()md.cpp:1248libgromacs_mpi.so.9.0.0
gmx::Mdrunner::mdrunner()runner.cpp:2311libgromacs_mpi.so.9.0.0
gmx::gmx_mdrun(int, gmx_hw_inf[...]mdrun.cpp:280gmx_mpi
gmx::gmx_mdrun(int, char**)mdrun.cpp:82gmx_mpi
gmx::CommandLineModuleManager:[...]cmdlinemodulemanager.cpp:569libgromacs_mpi.so.9.0.0
maingmx.cpp:58gmx_mpi
__libc_start_call_mainlibc.so.6
1.05+dih_angle(float const*, float [...]bonded.cpp:178libgromacs_mpi.so.9.0.0
float (anonymous namespace)::i[...]bonded.cpp:2298libgromacs_mpi.so.9.0.0
calculateSimpleBond(int, int, [...]bonded.cpp:4143libgromacs_mpi.so.9.0.0
(anonymous namespace)::calc_on[...]listed_forces.cpp:356libgromacs_mpi.so.9.0.0
.omp_outlined.#0xbe5d40listed_forces.cpp:428libgromacs_mpi.so.9.0.0
__kmp_invoke_microtasklibomp.so
__kmp_fork_calllibomp.so
__kmpc_fork_calllibomp.so
ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
do_force(_IO_FILE*, t_commrec [...]sim_util.cpp:2047libgromacs_mpi.so.9.0.0
gmx::LegacySimulator::do_md()md.cpp:1248libgromacs_mpi.so.9.0.0
gmx::Mdrunner::mdrunner()runner.cpp:2311libgromacs_mpi.so.9.0.0
gmx::gmx_mdrun(int, gmx_hw_inf[...]mdrun.cpp:280gmx_mpi
gmx::gmx_mdrun(int, char**)mdrun.cpp:82gmx_mpi
gmx::CommandLineModuleManager:[...]cmdlinemodulemanager.cpp:569libgromacs_mpi.so.9.0.0
maingmx.cpp:58gmx_mpi
__libc_start_call_mainlibc.so.6
1.05+void do_dih_fup<(BondedKernelF[...]bonded.cpp:129libgromacs_mpi.so.9.0.0
std::enable_if<(((BondedKernel[...]bonded.cpp:3031libgromacs_mpi.so.9.0.0
calculateSimpleBond(int, int, [...]bonded.cpp:4143libgromacs_mpi.so.9.0.0
(anonymous namespace)::calc_on[...]listed_forces.cpp:356libgromacs_mpi.so.9.0.0
.omp_outlined.#0xbe5d40listed_forces.cpp:428libgromacs_mpi.so.9.0.0
__kmp_invoke_microtasklibomp.so
__kmp_fork_calllibomp.so
__kmpc_fork_calllibomp.so
ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
do_force(_IO_FILE*, t_commrec [...]sim_util.cpp:2047libgromacs_mpi.so.9.0.0
gmx::LegacySimulator::do_md()md.cpp:1248libgromacs_mpi.so.9.0.0
gmx::Mdrunner::mdrunner()runner.cpp:2311libgromacs_mpi.so.9.0.0
gmx::gmx_mdrun(int, gmx_hw_inf[...]mdrun.cpp:280gmx_mpi
gmx::gmx_mdrun(int, char**)mdrun.cpp:82gmx_mpi
gmx::CommandLineModuleManager:[...]cmdlinemodulemanager.cpp:569libgromacs_mpi.so.9.0.0
maingmx.cpp:58gmx_mpi
__libc_start_call_mainlibc.so.6
Coverage (%)NameSource LocationModule
14.81+bond_angle(float const*, float[...]bonded.cpp:129libgromacs_mpi.so.9.0.0
std::enable_if<(((BondedKernel[...]bonded.cpp:1037libgromacs_mpi.so.9.0.0
calculateSimpleBond(int, int, [...]bonded.cpp:4143libgromacs_mpi.so.9.0.0
(anonymous namespace)::calc_on[...]listed_forces.cpp:356libgromacs_mpi.so.9.0.0
.omp_outlined.#0xbe5d40listed_forces.cpp:428libgromacs_mpi.so.9.0.0
__kmp_invoke_microtasklibomp.so
__kmp_fork_calllibomp.so
__kmpc_fork_calllibomp.so
ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
do_force(_IO_FILE*, t_commrec [...]sim_util.cpp:2047libgromacs_mpi.so.9.0.0
gmx::LegacySimulator::do_md()md.cpp:1248libgromacs_mpi.so.9.0.0
gmx::Mdrunner::mdrunner()runner.cpp:2311libgromacs_mpi.so.9.0.0
gmx::gmx_mdrun(int, gmx_hw_inf[...]mdrun.cpp:280gmx_mpi
gmx::gmx_mdrun(int, char**)mdrun.cpp:82gmx_mpi
gmx::CommandLineModuleManager:[...]cmdlinemodulemanager.cpp:569libgromacs_mpi.so.9.0.0
maingmx.cpp:58gmx_mpi
__libc_start_call_mainlibc.so.6
13.51+bond_angle(float const*, float[...]bonded.cpp:155libgromacs_mpi.so.9.0.0
std::enable_if<(((BondedKernel[...]bonded.cpp:1037libgromacs_mpi.so.9.0.0
calculateSimpleBond(int, int, [...]bonded.cpp:4143libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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Coverage (%)NameSource LocationModule
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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Coverage (%)NameSource LocationModule
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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maingmx.cpp:58gmx_mpi
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
do_force(_IO_FILE*, t_commrec [...]sim_util.cpp:2047libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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(anonymous namespace)::calc_on[...]listed_forces.cpp:356libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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calculateSimpleBond(int, int, [...]bonded.cpp:4143libgromacs_mpi.so.9.0.0
(anonymous namespace)::calc_on[...]listed_forces.cpp:356libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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calculateSimpleBond(int, int, [...]bonded.cpp:4143libgromacs_mpi.so.9.0.0
(anonymous namespace)::calc_on[...]listed_forces.cpp:356libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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calculateSimpleBond(int, int, [...]bonded.cpp:4143libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
do_force(_IO_FILE*, t_commrec [...]sim_util.cpp:2047libgromacs_mpi.so.9.0.0
gmx::LegacySimulator::do_md()md.cpp:1248libgromacs_mpi.so.9.0.0
gmx::Mdrunner::mdrunner()runner.cpp:2311libgromacs_mpi.so.9.0.0
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maingmx.cpp:58gmx_mpi
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calculateSimpleBond(int, int, [...]bonded.cpp:4143libgromacs_mpi.so.9.0.0
(anonymous namespace)::calc_on[...]listed_forces.cpp:356libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
do_force(_IO_FILE*, t_commrec [...]sim_util.cpp:2047libgromacs_mpi.so.9.0.0
gmx::LegacySimulator::do_md()md.cpp:1248libgromacs_mpi.so.9.0.0
gmx::Mdrunner::mdrunner()runner.cpp:2311libgromacs_mpi.so.9.0.0
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gmx::gmx_mdrun(int, char**)mdrun.cpp:82gmx_mpi
gmx::CommandLineModuleManager:[...]cmdlinemodulemanager.cpp:569libgromacs_mpi.so.9.0.0
Coverage (%)NameSource LocationModule
12.45+dih_angle(float const*, float [...]bonded.cpp:129libgromacs_mpi.so.9.0.0
std::enable_if<(((BondedKernel[...]bonded.cpp:1987libgromacs_mpi.so.9.0.0
calculateSimpleBond(int, int, [...]bonded.cpp:4143libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
do_force(_IO_FILE*, t_commrec [...]sim_util.cpp:2047libgromacs_mpi.so.9.0.0
gmx::LegacySimulator::do_md()md.cpp:1248libgromacs_mpi.so.9.0.0
gmx::Mdrunner::mdrunner()runner.cpp:2311libgromacs_mpi.so.9.0.0
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gmx::gmx_mdrun(int, char**)mdrun.cpp:82gmx_mpi
gmx::CommandLineModuleManager:[...]cmdlinemodulemanager.cpp:569libgromacs_mpi.so.9.0.0
maingmx.cpp:58gmx_mpi
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calculateSimpleBond(int, int, [...]bonded.cpp:4143libgromacs_mpi.so.9.0.0
(anonymous namespace)::calc_on[...]listed_forces.cpp:356libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
do_force(_IO_FILE*, t_commrec [...]sim_util.cpp:2047libgromacs_mpi.so.9.0.0
gmx::LegacySimulator::do_md()md.cpp:1248libgromacs_mpi.so.9.0.0
gmx::Mdrunner::mdrunner()runner.cpp:2311libgromacs_mpi.so.9.0.0
gmx::gmx_mdrun(int, gmx_hw_inf[...]mdrun.cpp:280gmx_mpi
gmx::gmx_mdrun(int, char**)mdrun.cpp:82gmx_mpi
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maingmx.cpp:58gmx_mpi
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calculateSimpleBond(int, int, [...]bonded.cpp:4143libgromacs_mpi.so.9.0.0
(anonymous namespace)::calc_on[...]listed_forces.cpp:356libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
do_force(_IO_FILE*, t_commrec [...]sim_util.cpp:2047libgromacs_mpi.so.9.0.0
gmx::LegacySimulator::do_md()md.cpp:1248libgromacs_mpi.so.9.0.0
gmx::Mdrunner::mdrunner()runner.cpp:2311libgromacs_mpi.so.9.0.0
gmx::gmx_mdrun(int, gmx_hw_inf[...]mdrun.cpp:280gmx_mpi
gmx::gmx_mdrun(int, char**)mdrun.cpp:82gmx_mpi
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
do_force(_IO_FILE*, t_commrec [...]sim_util.cpp:2047libgromacs_mpi.so.9.0.0
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gmx::Mdrunner::mdrunner()runner.cpp:2311libgromacs_mpi.so.9.0.0
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gmx::gmx_mdrun(int, char**)mdrun.cpp:82gmx_mpi
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maingmx.cpp:58gmx_mpi
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8.71+bond_angle(float const*, float[...]bonded.cpp:129libgromacs_mpi.so.9.0.0
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calculateSimpleBond(int, int, [...]bonded.cpp:4143libgromacs_mpi.so.9.0.0
(anonymous namespace)::calc_on[...]listed_forces.cpp:356libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
do_force(_IO_FILE*, t_commrec [...]sim_util.cpp:2047libgromacs_mpi.so.9.0.0
gmx::LegacySimulator::do_md()md.cpp:1248libgromacs_mpi.so.9.0.0
gmx::Mdrunner::mdrunner()runner.cpp:2311libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
do_force(_IO_FILE*, t_commrec [...]sim_util.cpp:2047libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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gmx::gmx_mdrun(int, gmx_hw_inf[...]mdrun.cpp:280gmx_mpi
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14.70+dih_angle(float const*, float [...]bonded.cpp:129libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
do_force(_IO_FILE*, t_commrec [...]sim_util.cpp:2047libgromacs_mpi.so.9.0.0
gmx::LegacySimulator::do_md()md.cpp:1248libgromacs_mpi.so.9.0.0
gmx::Mdrunner::mdrunner()runner.cpp:2311libgromacs_mpi.so.9.0.0
gmx::gmx_mdrun(int, gmx_hw_inf[...]mdrun.cpp:280gmx_mpi
gmx::gmx_mdrun(int, char**)mdrun.cpp:82gmx_mpi
gmx::CommandLineModuleManager:[...]cmdlinemodulemanager.cpp:569libgromacs_mpi.so.9.0.0
maingmx.cpp:58gmx_mpi
__libc_start_call_mainlibc.so.6
12.54+bond_angle(float const*, float[...]bonded.cpp:155libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
do_force(_IO_FILE*, t_commrec [...]sim_util.cpp:2047libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
do_force(_IO_FILE*, t_commrec [...]sim_util.cpp:2047libgromacs_mpi.so.9.0.0
gmx::LegacySimulator::do_md()md.cpp:1248libgromacs_mpi.so.9.0.0
gmx::Mdrunner::mdrunner()runner.cpp:2311libgromacs_mpi.so.9.0.0
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gmx::gmx_mdrun(int, char**)mdrun.cpp:82gmx_mpi
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maingmx.cpp:58gmx_mpi
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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gmx::gmx_mdrun(int, gmx_hw_inf[...]mdrun.cpp:280gmx_mpi
gmx::gmx_mdrun(int, char**)mdrun.cpp:82gmx_mpi
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calculateSimpleBond(int, int, [...]bonded.cpp:4143libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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gmx::Mdrunner::mdrunner()runner.cpp:2311libgromacs_mpi.so.9.0.0
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calculateSimpleBond(int, int, [...]bonded.cpp:4143libgromacs_mpi.so.9.0.0
(anonymous namespace)::calc_on[...]listed_forces.cpp:356libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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gmx::Mdrunner::mdrunner()runner.cpp:2311libgromacs_mpi.so.9.0.0
gmx::gmx_mdrun(int, gmx_hw_inf[...]mdrun.cpp:280gmx_mpi
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(anonymous namespace)::calc_on[...]listed_forces.cpp:356libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
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gmx::Mdrunner::mdrunner()runner.cpp:2311libgromacs_mpi.so.9.0.0
gmx::gmx_mdrun(int, gmx_hw_inf[...]mdrun.cpp:280gmx_mpi
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calculateSimpleBond(int, int, [...]bonded.cpp:4143libgromacs_mpi.so.9.0.0
(anonymous namespace)::calc_on[...]listed_forces.cpp:356libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
do_force(_IO_FILE*, t_commrec [...]sim_util.cpp:2047libgromacs_mpi.so.9.0.0
gmx::LegacySimulator::do_md()md.cpp:1248libgromacs_mpi.so.9.0.0
gmx::Mdrunner::mdrunner()runner.cpp:2311libgromacs_mpi.so.9.0.0
gmx::gmx_mdrun(int, gmx_hw_inf[...]mdrun.cpp:280gmx_mpi
gmx::gmx_mdrun(int, char**)mdrun.cpp:82gmx_mpi
gmx::CommandLineModuleManager:[...]cmdlinemodulemanager.cpp:569libgromacs_mpi.so.9.0.0
maingmx.cpp:58gmx_mpi
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calculateSimpleBond(int, int, [...]bonded.cpp:4143libgromacs_mpi.so.9.0.0
(anonymous namespace)::calc_on[...]listed_forces.cpp:356libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
do_force(_IO_FILE*, t_commrec [...]sim_util.cpp:2047libgromacs_mpi.so.9.0.0
gmx::LegacySimulator::do_md()md.cpp:1248libgromacs_mpi.so.9.0.0
gmx::Mdrunner::mdrunner()runner.cpp:2311libgromacs_mpi.so.9.0.0
gmx::gmx_mdrun(int, gmx_hw_inf[...]mdrun.cpp:280gmx_mpi
gmx::gmx_mdrun(int, char**)mdrun.cpp:82gmx_mpi
gmx::CommandLineModuleManager:[...]cmdlinemodulemanager.cpp:569libgromacs_mpi.so.9.0.0
maingmx.cpp:58gmx_mpi
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3.58+dih_angle(float const*, float [...]bonded.cpp:179libgromacs_mpi.so.9.0.0
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calculateSimpleBond(int, int, [...]bonded.cpp:4143libgromacs_mpi.so.9.0.0
(anonymous namespace)::calc_on[...]listed_forces.cpp:356libgromacs_mpi.so.9.0.0
.omp_outlined.#0xbe5d40listed_forces.cpp:428libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
do_force(_IO_FILE*, t_commrec [...]sim_util.cpp:2047libgromacs_mpi.so.9.0.0
gmx::LegacySimulator::do_md()md.cpp:1248libgromacs_mpi.so.9.0.0
gmx::Mdrunner::mdrunner()runner.cpp:2311libgromacs_mpi.so.9.0.0
gmx::gmx_mdrun(int, gmx_hw_inf[...]mdrun.cpp:280gmx_mpi
gmx::gmx_mdrun(int, char**)mdrun.cpp:82gmx_mpi
gmx::CommandLineModuleManager:[...]cmdlinemodulemanager.cpp:569libgromacs_mpi.so.9.0.0
maingmx.cpp:58gmx_mpi
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calculateSimpleBond(int, int, [...]bonded.cpp:4143libgromacs_mpi.so.9.0.0
(anonymous namespace)::calc_on[...]listed_forces.cpp:356libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
do_force(_IO_FILE*, t_commrec [...]sim_util.cpp:2047libgromacs_mpi.so.9.0.0
gmx::LegacySimulator::do_md()md.cpp:1248libgromacs_mpi.so.9.0.0
gmx::Mdrunner::mdrunner()runner.cpp:2311libgromacs_mpi.so.9.0.0
gmx::gmx_mdrun(int, gmx_hw_inf[...]mdrun.cpp:280gmx_mpi
gmx::gmx_mdrun(int, char**)mdrun.cpp:82gmx_mpi
gmx::CommandLineModuleManager:[...]cmdlinemodulemanager.cpp:569libgromacs_mpi.so.9.0.0
maingmx.cpp:58gmx_mpi
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calculateSimpleBond(int, int, [...]bonded.cpp:4143libgromacs_mpi.so.9.0.0
(anonymous namespace)::calc_on[...]listed_forces.cpp:356libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
do_force(_IO_FILE*, t_commrec [...]sim_util.cpp:2047libgromacs_mpi.so.9.0.0
gmx::LegacySimulator::do_md()md.cpp:1248libgromacs_mpi.so.9.0.0
gmx::Mdrunner::mdrunner()runner.cpp:2311libgromacs_mpi.so.9.0.0
gmx::gmx_mdrun(int, gmx_hw_inf[...]mdrun.cpp:280gmx_mpi
gmx::gmx_mdrun(int, char**)mdrun.cpp:82gmx_mpi
gmx::CommandLineModuleManager:[...]cmdlinemodulemanager.cpp:569libgromacs_mpi.so.9.0.0
maingmx.cpp:58gmx_mpi
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calculateSimpleBond(int, int, [...]bonded.cpp:4143libgromacs_mpi.so.9.0.0
(anonymous namespace)::calc_on[...]listed_forces.cpp:356libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
do_force(_IO_FILE*, t_commrec [...]sim_util.cpp:2047libgromacs_mpi.so.9.0.0
gmx::LegacySimulator::do_md()md.cpp:1248libgromacs_mpi.so.9.0.0
gmx::Mdrunner::mdrunner()runner.cpp:2311libgromacs_mpi.so.9.0.0
gmx::gmx_mdrun(int, gmx_hw_inf[...]mdrun.cpp:280gmx_mpi
gmx::gmx_mdrun(int, char**)mdrun.cpp:82gmx_mpi
gmx::CommandLineModuleManager:[...]cmdlinemodulemanager.cpp:569libgromacs_mpi.so.9.0.0
maingmx.cpp:58gmx_mpi
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calculateSimpleBond(int, int, [...]bonded.cpp:4143libgromacs_mpi.so.9.0.0
(anonymous namespace)::calc_on[...]listed_forces.cpp:356libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
do_force(_IO_FILE*, t_commrec [...]sim_util.cpp:2047libgromacs_mpi.so.9.0.0
gmx::LegacySimulator::do_md()md.cpp:1248libgromacs_mpi.so.9.0.0
gmx::Mdrunner::mdrunner()runner.cpp:2311libgromacs_mpi.so.9.0.0
gmx::gmx_mdrun(int, gmx_hw_inf[...]mdrun.cpp:280gmx_mpi
1.08+std::enable_if<(((BondedKernel[...]bonded.cpp:1987libgromacs_mpi.so.9.0.0
calculateSimpleBond(int, int, [...]bonded.cpp:4143libgromacs_mpi.so.9.0.0
(anonymous namespace)::calc_on[...]listed_forces.cpp:356libgromacs_mpi.so.9.0.0
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ListedForces::calculate(gmx_wa[...]listed_forces.cpp:387libgromacs_mpi.so.9.0.0
do_force(_IO_FILE*, t_commrec [...]sim_util.cpp:2047libgromacs_mpi.so.9.0.0
gmx::LegacySimulator::do_md()md.cpp:1248libgromacs_mpi.so.9.0.0
gmx::Mdrunner::mdrunner()runner.cpp:2311libgromacs_mpi.so.9.0.0
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gmx::gmx_mdrun(int, char**)mdrun.cpp:82gmx_mpi
gmx::CommandLineModuleManager:[...]cmdlinemodulemanager.cpp:569libgromacs_mpi.so.9.0.0
maingmx.cpp:58gmx_mpi
__libc_start_call_mainlibc.so.6
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