Loop Id: 1744 | Module: libgromacs_mpi.so.9.0.0 | Source: pairlist.cpp:1330-1430 [...] | Coverage: 0.01% |
---|
Loop Id: 1744 | Module: libgromacs_mpi.so.9.0.0 | Source: pairlist.cpp:1330-1430 [...] | Coverage: 0.01% |
---|
0x660bd0 INC %R13D |
0x660bd3 MOV -0x40(%R15),%EAX |
0x660bd7 CMP %EAX,%R13D |
0x660bda JGE 660e40 |
0x660be0 IMUL 0x48(%RSP),%EAX |
0x660be5 ADD %R13D,%EAX |
0x660be8 MOVSXD %EAX,%RCX |
0x660beb MOV 0xa8(%RSP),%RDX |
0x660bf3 MOV (%RDX,%RCX,4),%R9D |
0x660bf7 TEST %R9D,%R9D |
0x660bfa JS 660bd0 |
0x660bfc MOV 0xc8(%RSP),%RDX |
0x660c04 MOVSXD (%RDX,%R9,4),%RCX |
0x660c08 MOVSXD 0x4(%RDX,%R9,4),%RDX |
0x660c0d CMP %EDX,%ECX |
0x660c0f JE 660bd0 |
0x660c11 MOV 0xc0(%RSP),%RSI |
0x660c19 LEA (%RSI,%RDX,4),%R11 |
0x660c1d LEA (%RSI,%RCX,4),%R14 |
0x660c21 MOV 0x1d8(%RSP),%ECX |
0x660c28 SHLX %ECX,%R13D,%ECX |
0x660c2d MOV %ECX,0xd0(%RSP) |
0x660c34 CMPB $0,0x60(%RSP) |
0x660c39 JE 660d6d |
0x660c3f JMP 660c5d |
(1747) 0x660c50 ADD $0x4,%R14 |
(1747) 0x660c54 CMP %R11,%R14 |
(1747) 0x660c57 JE 660bd0 |
(1747) 0x660c5d MOVSXD (%R14),%RCX |
(1747) 0x660c60 CMP %R9D,%ECX |
(1747) 0x660c63 JE 660c50 |
(1747) 0x660c65 MOV (%RBX,%RCX,4),%ECX |
(1747) 0x660c68 CMP %EAX,%ECX |
(1747) 0x660c6a JLE 660c50 |
(1747) 0x660c6c MOV 0x1d8(%RSP),%EDX |
(1747) 0x660c73 SARX %EDX,%ECX,%EDX |
(1747) 0x660c78 CMP %R8D,%EDX |
(1747) 0x660c7b JL 660c50 |
(1747) 0x660c7d CMP 0x50(%RSP),%EDX |
(1747) 0x660c81 JG 660c50 |
(1747) 0x660c83 MOV (%R15),%R12 |
(1747) 0x660c86 CMP %EDX,0x58(%RSP) |
(1747) 0x660c8a JLE 660ce0 |
(1747) 0x660c8c MOV 0x120(%RSP),%RSI |
(1747) 0x660c94 ADD %EDX,%ESI |
(1747) 0x660c96 TEST %ESI,%ESI |
(1747) 0x660c98 MOV 0x98(%RSP),%R15 |
(1747) 0x660ca0 MOV 0x90(%RSP),%EDI |
(1747) 0x660ca7 MOV 0xf0(%RSP),%R8 |
(1747) 0x660caf JS 660c50 |
(1747) 0x660cb1 MOV 0x1d8(%RSP),%EDI |
(1747) 0x660cb8 SHLX %EDI,%EDX,%EDX |
(1747) 0x660cbd MOV 0x90(%RSP),%EDI |
(1747) 0x660cc4 ADD 0xd0(%RSP),%ECX |
(1747) 0x660ccb SUB %EDX,%ECX |
(1747) 0x660ccd MOV $-0x2,%EDX |
(1747) 0x660cd2 ROL %CL,%EDX |
(1747) 0x660cd4 MOV %ESI,%ECX |
(1747) 0x660cd6 AND %EDX,0x4(%R12,%RCX,8) |
(1747) 0x660cdb JMP 660c50 |
(1747) 0x660ce0 MOV 0x70(%RSP),%RSI |
(1747) 0x660ce5 CMP 0x1a0(%RSP),%ESI |
(1747) 0x660cec JGE 660c50 |
(1747) 0x660cf2 MOV 0x1a0(%RSP),%R8D |
(1747) 0x660cfa MOV 0x70(%RSP),%RSI |
(1747) 0x660cff MOV %ESI,%R15D |
(1747) 0x660d02 NOPW %CS:(%RAX,%RAX,1) |
(1748) 0x660d10 MOV %R15D,%ESI |
(1748) 0x660d13 MOV %R8D,%R10D |
(1748) 0x660d16 LEA (%RSI,%R10,1),%R8D |
(1748) 0x660d1a SAR $0x1,%R8D |
(1748) 0x660d1d MOVSXD %R8D,%RDI |
(1748) 0x660d20 LEA 0x1(%RDI),%R15D |
(1748) 0x660d24 CMP %EDX,(%R12,%RDI,8) |
(1748) 0x660d28 MOV %R10D,%R8D |
(1748) 0x660d2b CMOVG %EDI,%R8D |
(1748) 0x660d2f CMOVGE %ESI,%R15D |
(1748) 0x660d33 CMOVE %R10D,%R8D |
(1748) 0x660d37 MOV $-0x1,%ESI |
(1748) 0x660d3c CMOVE %EDI,%ESI |
(1748) 0x660d3f CMP $-0x1,%ESI |
(1748) 0x660d42 JNE 660c96 |
(1748) 0x660d48 CMP %R8D,%R15D |
(1748) 0x660d4b JL 660d10 |
(1747) 0x660d4d JMP 660c96 |
(1745) 0x660d60 ADD $0x4,%R14 |
(1745) 0x660d64 CMP %R11,%R14 |
(1745) 0x660d67 JE 660bd0 |
(1745) 0x660d6d MOVSXD (%R14),%RAX |
(1745) 0x660d70 CMP %R9D,%EAX |
(1745) 0x660d73 JE 660d60 |
(1745) 0x660d75 MOV (%RBX,%RAX,4),%ECX |
(1745) 0x660d78 MOV 0x1d8(%RSP),%EAX |
(1745) 0x660d7f SARX %EAX,%ECX,%R12D |
(1745) 0x660d84 CMP %R8D,%R12D |
(1745) 0x660d87 JL 660d60 |
(1745) 0x660d89 CMP 0x50(%RSP),%R12D |
(1745) 0x660d8e JG 660d60 |
(1745) 0x660d90 MOV (%R15),%RAX |
(1745) 0x660d93 CMP %R12D,0x58(%RSP) |
(1745) 0x660d98 JLE 660ddc |
(1745) 0x660d9a MOV 0x120(%RSP),%RDX |
(1745) 0x660da2 ADD %R12D,%EDX |
(1745) 0x660da5 TEST %EDX,%EDX |
(1745) 0x660da7 MOV 0x90(%RSP),%EDI |
(1745) 0x660dae MOV 0xf0(%RSP),%R8 |
(1745) 0x660db6 JS 660d60 |
(1745) 0x660db8 MOV 0x1d8(%RSP),%ESI |
(1745) 0x660dbf SHLX %ESI,%R12D,%ESI |
(1745) 0x660dc4 ADD 0xd0(%RSP),%ECX |
(1745) 0x660dcb SUB %ESI,%ECX |
(1745) 0x660dcd MOV $-0x2,%ESI |
(1745) 0x660dd2 ROL %CL,%ESI |
(1745) 0x660dd4 MOV %EDX,%ECX |
(1745) 0x660dd6 AND %ESI,0x4(%RAX,%RCX,8) |
(1745) 0x660dda JMP 660d60 |
(1745) 0x660ddc MOV 0x70(%RSP),%RDX |
(1745) 0x660de1 CMP 0x1a0(%RSP),%EDX |
(1745) 0x660de8 JGE 660d60 |
(1745) 0x660dee MOV 0x1a0(%RSP),%ESI |
(1745) 0x660df5 MOV 0x70(%RSP),%RDX |
(1745) 0x660dfa MOV %EDX,%R8D |
(1745) 0x660dfd NOPL (%RAX) |
(1746) 0x660e00 MOV %R8D,%EDX |
(1746) 0x660e03 MOV %ESI,%EDI |
(1746) 0x660e05 LEA (%RDX,%RDI,1),%ESI |
(1746) 0x660e08 SAR $0x1,%ESI |
(1746) 0x660e0a MOVSXD %ESI,%R10 |
(1746) 0x660e0d LEA 0x1(%R10),%R8D |
(1746) 0x660e11 CMP %R12D,(%RAX,%R10,8) |
(1746) 0x660e15 MOV %EDI,%ESI |
(1746) 0x660e17 CMOVG %R10D,%ESI |
(1746) 0x660e1b CMOVGE %EDX,%R8D |
(1746) 0x660e1f CMOVE %EDI,%ESI |
(1746) 0x660e22 MOV $-0x1,%EDX |
(1746) 0x660e27 CMOVE %R10D,%EDX |
(1746) 0x660e2b CMP $-0x1,%EDX |
(1746) 0x660e2e JNE 660da5 |
(1746) 0x660e34 CMP %ESI,%R8D |
(1746) 0x660e37 JL 660e00 |
(1745) 0x660e39 JMP 660da5 |
/home/eoseret/gromacs-2024.2/api/legacy/include/gromacs/utility/arrayref.h: 82 - 82 |
-------------------------------------------------------------------------------- |
82: it_ += i; |
/home/eoseret/gromacs-2024.2/api/legacy/include/gromacs/utility/listoflists.h: 145 - 146 |
-------------------------------------------------------------------------------- |
145: return ArrayRef<const T>(elements_.data() + listRanges_[listIndex], |
146: elements_.data() + listRanges_[listIndex + 1]); |
/home/eoseret/gromacs-2024.2/src/gromacs/nbnxm/pairlist.h: 102 - 106 |
-------------------------------------------------------------------------------- |
102: int cj(int index) const { return list_[index].cj; } |
103: //! Return the exclusion mask for \c index |
104: const unsigned int& excl(int index) const { return list_[index].excl; } |
105: //! Return the exclusion mask for \c index |
106: unsigned int& excl(int index) { return list_[index].excl; } |
/home/eoseret/gromacs-2024.2/src/external/boost/stl_interfaces/iterator_interface.hpp: 459 - 459 |
-------------------------------------------------------------------------------- |
459: return detail::common_diff(lhs, rhs) == 0; |
/home/eoseret/gromacs-2024.2/src/gromacs/nbnxm/pairlist.cpp: 1330 - 1430 |
-------------------------------------------------------------------------------- |
1330: if (jCluster < ranges.cjFirst + ranges.numDirect) |
1331: { |
1332: /* We can calculate the index directly using the offset */ |
1333: return ranges.cjIndexStart + jCluster - ranges.cjFirst; |
[...] |
1341: while (index == -1 && rangeStart < rangeEnd) |
1342: { |
1343: int rangeMiddle = (rangeStart + rangeEnd) >> 1; |
1344: |
1345: const int clusterMiddle = cjList.cj(rangeMiddle); |
1346: |
1347: if (jCluster == clusterMiddle) |
[...] |
1390: for (int i = 0; i < nbl->na_ci; i++) |
1391: { |
1392: const int iIndex = iCluster * nbl->na_ci + i; |
1393: const int iAtom = atomIndices[iIndex]; |
1394: if (iAtom >= 0) |
1395: { |
1396: /* Loop over the topology-based exclusions for this i-atom */ |
1397: for (const int jAtom : exclusions[iAtom]) |
1398: { |
1399: if (jAtom == iAtom) |
[...] |
1406: const int jIndex = cell[jAtom]; |
1407: |
1408: /* Without shifts we only calculate interactions j>i |
1409: * for one-way pair-lists. |
1410: */ |
1411: if (diagRemoved && jIndex <= iIndex) |
1412: { |
1413: continue; |
1414: } |
1415: |
1416: const int jCluster = (jIndex >> na_cj_2log); |
1417: |
1418: /* Could the cluster se be in our list? */ |
1419: if (jCluster >= ranges.cjFirst && jCluster <= ranges.cjLast) |
1420: { |
1421: const int index = findJClusterInJList(jCluster, ranges, nbl->cj); |
1422: |
1423: if (index >= 0) |
1424: { |
1425: /* We found an exclusion, clear the corresponding |
1426: * interaction bit. |
1427: */ |
1428: const int innerJ = jIndex - (jCluster << na_cj_2log); |
1429: |
1430: nbl->cj.excl(index) &= ~(1U << ((i << na_cj_2log) + innerJ)); |
Coverage (%) | Name | Source Location | Module |
---|---|---|---|
►100.00+ | __kmp_invoke_microtask | libomp.so | |
○ | __kmp_fork_call | libomp.so | |
○ | __kmpc_fork_call | libomp.so | |
○ | PairlistSet::constructPairlist[...] | pairlist.cpp:4066 | libgromacs_mpi.so.9.0.0 |
○ | PairlistSets::construct(gmx::I[...] | pairlist.cpp:4322 | libgromacs_mpi.so.9.0.0 |
○ | nonbonded_verlet_t::constructP[...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | do_force(_IO_FILE*, t_commrec [...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | gmx::LegacySimulator::do_md() | md.cpp:1248 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:2311 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 |
Coverage (%) | Name | Source Location | Module |
---|---|---|---|
►75.76+ | __kmp_invoke_microtask | libomp.so | |
○ | __kmp_fork_call | libomp.so | |
○ | __kmpc_fork_call | libomp.so | |
○ | PairlistSet::constructPairlist[...] | pairlist.cpp:4066 | libgromacs_mpi.so.9.0.0 |
○ | PairlistSets::construct(gmx::I[...] | pairlist.cpp:4322 | libgromacs_mpi.so.9.0.0 |
○ | nonbonded_verlet_t::constructP[...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | do_force(_IO_FILE*, t_commrec [...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | gmx::LegacySimulator::do_md() | md.cpp:1248 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:2311 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►24.24+ | __kmp_invoke_microtask | libomp.so | |
○ | __kmp_fork_call | libomp.so | |
○ | __kmpc_fork_call | libomp.so | |
○ | PairlistSet::constructPairlist[...] | pairlist.cpp:4066 | libgromacs_mpi.so.9.0.0 |
○ | PairlistSets::construct(gmx::I[...] | pairlist.cpp:4322 | libgromacs_mpi.so.9.0.0 |
○ | nonbonded_verlet_t::constructP[...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | do_force(_IO_FILE*, t_commrec [...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | gmx::LegacySimulator::do_md() | md.cpp:1248 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:2311 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 |
Coverage (%) | Name | Source Location | Module |
---|---|---|---|
►69.05+ | __kmp_invoke_microtask | libomp.so | |
○ | __kmp_fork_call | libomp.so | |
○ | __kmpc_fork_call | libomp.so | |
○ | PairlistSet::constructPairlist[...] | pairlist.cpp:4066 | libgromacs_mpi.so.9.0.0 |
○ | PairlistSets::construct(gmx::I[...] | pairlist.cpp:4322 | libgromacs_mpi.so.9.0.0 |
○ | nonbonded_verlet_t::constructP[...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | do_force(_IO_FILE*, t_commrec [...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | gmx::LegacySimulator::do_md() | md.cpp:1248 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:2311 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►30.95+ | __kmp_invoke_microtask | libomp.so | |
○ | __kmp_fork_call | libomp.so | |
○ | __kmpc_fork_call | libomp.so | |
○ | PairlistSet::constructPairlist[...] | pairlist.cpp:4066 | libgromacs_mpi.so.9.0.0 |
○ | PairlistSets::construct(gmx::I[...] | pairlist.cpp:4322 | libgromacs_mpi.so.9.0.0 |
○ | nonbonded_verlet_t::constructP[...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | do_force(_IO_FILE*, t_commrec [...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | gmx::LegacySimulator::do_md() | md.cpp:1248 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:2311 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 |
Coverage (%) | Name | Source Location | Module |
---|---|---|---|
►47.17+ | __kmp_invoke_microtask | libomp.so | |
○ | __kmp_fork_call | libomp.so | |
○ | __kmpc_fork_call | libomp.so | |
○ | PairlistSet::constructPairlist[...] | pairlist.cpp:4066 | libgromacs_mpi.so.9.0.0 |
○ | PairlistSets::construct(gmx::I[...] | pairlist.cpp:4322 | libgromacs_mpi.so.9.0.0 |
○ | nonbonded_verlet_t::constructP[...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | do_force(_IO_FILE*, t_commrec [...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | gmx::LegacySimulator::do_md() | md.cpp:1248 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:2311 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►28.30+ | __kmp_invoke_microtask | libomp.so | |
○ | __kmp_fork_call | libomp.so | |
○ | __kmpc_fork_call | libomp.so | |
○ | PairlistSet::constructPairlist[...] | pairlist.cpp:4066 | libgromacs_mpi.so.9.0.0 |
○ | PairlistSets::construct(gmx::I[...] | pairlist.cpp:4322 | libgromacs_mpi.so.9.0.0 |
○ | nonbonded_verlet_t::constructP[...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | do_force(_IO_FILE*, t_commrec [...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | gmx::LegacySimulator::do_md() | md.cpp:1248 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:2311 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►7.55+ | __kmp_invoke_microtask | libomp.so | |
○ | __kmp_fork_call | libomp.so | |
○ | __kmpc_fork_call | libomp.so | |
○ | PairlistSet::constructPairlist[...] | pairlist.cpp:4066 | libgromacs_mpi.so.9.0.0 |
○ | PairlistSets::construct(gmx::I[...] | pairlist.cpp:4322 | libgromacs_mpi.so.9.0.0 |
○ | nonbonded_verlet_t::constructP[...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | do_force(_IO_FILE*, t_commrec [...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | gmx::LegacySimulator::do_md() | md.cpp:1248 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:2311 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
►7.55+ | __kmp_invoke_microtask | libomp.so | |
○ | __kmp_fork_call | libomp.so | |
○ | __kmpc_fork_call | libomp.so | |
○ | PairlistSet::constructPairlist[...] | pairlist.cpp:4066 | libgromacs_mpi.so.9.0.0 |
○ | PairlistSets::construct(gmx::I[...] | pairlist.cpp:4322 | libgromacs_mpi.so.9.0.0 |
○ | nonbonded_verlet_t::constructP[...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | do_force(_IO_FILE*, t_commrec [...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | gmx::LegacySimulator::do_md() | md.cpp:1248 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:2311 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
►5.66+ | __kmp_invoke_microtask | libomp.so | |
○ | __kmp_fork_call | libomp.so | |
○ | __kmpc_fork_call | libomp.so | |
○ | PairlistSet::constructPairlist[...] | pairlist.cpp:4066 | libgromacs_mpi.so.9.0.0 |
○ | PairlistSets::construct(gmx::I[...] | pairlist.cpp:4322 | libgromacs_mpi.so.9.0.0 |
○ | nonbonded_verlet_t::constructP[...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | do_force(_IO_FILE*, t_commrec [...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | gmx::LegacySimulator::do_md() | md.cpp:1248 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:2311 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
►3.77+ | __kmp_invoke_microtask | libomp.so | |
○ | __kmp_fork_call | libomp.so | |
○ | __kmpc_fork_call | libomp.so | |
○ | PairlistSet::constructPairlist[...] | pairlist.cpp:4066 | libgromacs_mpi.so.9.0.0 |
○ | PairlistSets::construct(gmx::I[...] | pairlist.cpp:4322 | libgromacs_mpi.so.9.0.0 |
○ | nonbonded_verlet_t::constructP[...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | do_force(_IO_FILE*, t_commrec [...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | gmx::LegacySimulator::do_md() | md.cpp:1248 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:2311 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
Coverage (%) | Name | Source Location | Module |
---|---|---|---|
►55.10+ | __kmp_invoke_microtask | libomp.so | |
○ | __kmp_fork_call | libomp.so | |
○ | __kmpc_fork_call | libomp.so | |
○ | PairlistSet::constructPairlist[...] | pairlist.cpp:4066 | libgromacs_mpi.so.9.0.0 |
○ | PairlistSets::construct(gmx::I[...] | pairlist.cpp:4322 | libgromacs_mpi.so.9.0.0 |
○ | nonbonded_verlet_t::constructP[...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | do_force(_IO_FILE*, t_commrec [...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | gmx::LegacySimulator::do_md() | md.cpp:1248 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:2311 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►24.49+ | __kmp_invoke_microtask | libomp.so | |
○ | __kmp_fork_call | libomp.so | |
○ | __kmpc_fork_call | libomp.so | |
○ | PairlistSet::constructPairlist[...] | pairlist.cpp:4066 | libgromacs_mpi.so.9.0.0 |
○ | PairlistSets::construct(gmx::I[...] | pairlist.cpp:4322 | libgromacs_mpi.so.9.0.0 |
○ | nonbonded_verlet_t::constructP[...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | do_force(_IO_FILE*, t_commrec [...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | gmx::LegacySimulator::do_md() | md.cpp:1248 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:2311 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►8.16+ | __kmp_invoke_microtask | libomp.so | |
○ | __kmp_fork_call | libomp.so | |
○ | __kmpc_fork_call | libomp.so | |
○ | PairlistSet::constructPairlist[...] | pairlist.cpp:4066 | libgromacs_mpi.so.9.0.0 |
○ | PairlistSets::construct(gmx::I[...] | pairlist.cpp:4322 | libgromacs_mpi.so.9.0.0 |
○ | nonbonded_verlet_t::constructP[...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | do_force(_IO_FILE*, t_commrec [...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | gmx::LegacySimulator::do_md() | md.cpp:1248 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:2311 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
►8.16+ | __kmp_invoke_microtask | libomp.so | |
○ | __kmp_fork_call | libomp.so | |
○ | __kmpc_fork_call | libomp.so | |
○ | PairlistSet::constructPairlist[...] | pairlist.cpp:4066 | libgromacs_mpi.so.9.0.0 |
○ | PairlistSets::construct(gmx::I[...] | pairlist.cpp:4322 | libgromacs_mpi.so.9.0.0 |
○ | nonbonded_verlet_t::constructP[...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | do_force(_IO_FILE*, t_commrec [...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | gmx::LegacySimulator::do_md() | md.cpp:1248 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:2311 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
►2.04+ | __kmp_invoke_microtask | libomp.so | |
○ | __kmp_fork_call | libomp.so | |
○ | __kmpc_fork_call | libomp.so | |
○ | PairlistSet::constructPairlist[...] | pairlist.cpp:4066 | libgromacs_mpi.so.9.0.0 |
○ | PairlistSets::construct(gmx::I[...] | pairlist.cpp:4322 | libgromacs_mpi.so.9.0.0 |
○ | nonbonded_verlet_t::constructP[...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | do_force(_IO_FILE*, t_commrec [...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | gmx::LegacySimulator::do_md() | md.cpp:1248 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:2311 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
►2.04+ | __kmp_invoke_microtask | libomp.so | |
○ | __kmp_fork_call | libomp.so | |
○ | __kmpc_fork_call | libomp.so | |
○ | PairlistSet::constructPairlist[...] | pairlist.cpp:4066 | libgromacs_mpi.so.9.0.0 |
○ | PairlistSets::construct(gmx::I[...] | pairlist.cpp:4322 | libgromacs_mpi.so.9.0.0 |
○ | nonbonded_verlet_t::constructP[...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | do_force(_IO_FILE*, t_commrec [...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | gmx::LegacySimulator::do_md() | md.cpp:1248 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:2311 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
Coverage (%) | Name | Source Location | Module |
---|---|---|---|
►41.30+ | __kmp_invoke_microtask | libomp.so | |
○ | __kmp_fork_call | libomp.so | |
○ | __kmpc_fork_call | libomp.so | |
○ | PairlistSet::constructPairlist[...] | pairlist.cpp:4066 | libgromacs_mpi.so.9.0.0 |
○ | PairlistSets::construct(gmx::I[...] | pairlist.cpp:4322 | libgromacs_mpi.so.9.0.0 |
○ | nonbonded_verlet_t::constructP[...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | do_force(_IO_FILE*, t_commrec [...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | gmx::LegacySimulator::do_md() | md.cpp:1248 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:2311 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►41.30+ | __kmp_invoke_microtask | libomp.so | |
○ | __kmp_fork_call | libomp.so | |
○ | __kmpc_fork_call | libomp.so | |
○ | PairlistSet::constructPairlist[...] | pairlist.cpp:4066 | libgromacs_mpi.so.9.0.0 |
○ | PairlistSets::construct(gmx::I[...] | pairlist.cpp:4322 | libgromacs_mpi.so.9.0.0 |
○ | nonbonded_verlet_t::constructP[...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | do_force(_IO_FILE*, t_commrec [...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | gmx::LegacySimulator::do_md() | md.cpp:1248 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:2311 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►8.70+ | __kmp_invoke_microtask | libomp.so | |
○ | __kmp_fork_call | libomp.so | |
○ | __kmpc_fork_call | libomp.so | |
○ | PairlistSet::constructPairlist[...] | pairlist.cpp:4066 | libgromacs_mpi.so.9.0.0 |
○ | PairlistSets::construct(gmx::I[...] | pairlist.cpp:4322 | libgromacs_mpi.so.9.0.0 |
○ | nonbonded_verlet_t::constructP[...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | do_force(_IO_FILE*, t_commrec [...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | gmx::LegacySimulator::do_md() | md.cpp:1248 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:2311 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
►4.35+ | __kmp_invoke_microtask | libomp.so | |
○ | __kmp_fork_call | libomp.so | |
○ | __kmpc_fork_call | libomp.so | |
○ | PairlistSet::constructPairlist[...] | pairlist.cpp:4066 | libgromacs_mpi.so.9.0.0 |
○ | PairlistSets::construct(gmx::I[...] | pairlist.cpp:4322 | libgromacs_mpi.so.9.0.0 |
○ | nonbonded_verlet_t::constructP[...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | do_force(_IO_FILE*, t_commrec [...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | gmx::LegacySimulator::do_md() | md.cpp:1248 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:2311 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
►4.35+ | __kmp_invoke_microtask | libomp.so | |
○ | __kmp_fork_call | libomp.so | |
○ | __kmpc_fork_call | libomp.so | |
○ | PairlistSet::constructPairlist[...] | pairlist.cpp:4066 | libgromacs_mpi.so.9.0.0 |
○ | PairlistSets::construct(gmx::I[...] | pairlist.cpp:4322 | libgromacs_mpi.so.9.0.0 |
○ | nonbonded_verlet_t::constructP[...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | do_force(_IO_FILE*, t_commrec [...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | gmx::LegacySimulator::do_md() | md.cpp:1248 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:2311 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
Coverage (%) | Name | Source Location | Module |
---|---|---|---|
►64.71+ | __kmp_invoke_microtask | libomp.so | |
○ | __kmp_fork_call | libomp.so | |
○ | __kmpc_fork_call | libomp.so | |
○ | PairlistSet::constructPairlist[...] | pairlist.cpp:4066 | libgromacs_mpi.so.9.0.0 |
○ | PairlistSets::construct(gmx::I[...] | pairlist.cpp:4322 | libgromacs_mpi.so.9.0.0 |
○ | nonbonded_verlet_t::constructP[...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | do_force(_IO_FILE*, t_commrec [...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | gmx::LegacySimulator::do_md() | md.cpp:1248 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:2311 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►35.29+ | __kmp_invoke_microtask | libomp.so | |
○ | __kmp_fork_call | libomp.so | |
○ | __kmpc_fork_call | libomp.so | |
○ | PairlistSet::constructPairlist[...] | pairlist.cpp:4066 | libgromacs_mpi.so.9.0.0 |
○ | PairlistSets::construct(gmx::I[...] | pairlist.cpp:4322 | libgromacs_mpi.so.9.0.0 |
○ | nonbonded_verlet_t::constructP[...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | do_force(_IO_FILE*, t_commrec [...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | gmx::LegacySimulator::do_md() | md.cpp:1248 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:2311 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 |
Coverage (%) | Name | Source Location | Module |
---|---|---|---|
►55.13+ | __kmp_invoke_microtask | libomp.so | |
○ | __kmp_fork_call | libomp.so | |
○ | __kmpc_fork_call | libomp.so | |
○ | PairlistSet::constructPairlist[...] | pairlist.cpp:4066 | libgromacs_mpi.so.9.0.0 |
○ | PairlistSets::construct(gmx::I[...] | pairlist.cpp:4322 | libgromacs_mpi.so.9.0.0 |
○ | nonbonded_verlet_t::constructP[...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | do_force(_IO_FILE*, t_commrec [...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | gmx::LegacySimulator::do_md() | md.cpp:1248 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:2311 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►30.77+ | __kmp_invoke_microtask | libomp.so | |
○ | __kmp_fork_call | libomp.so | |
○ | __kmpc_fork_call | libomp.so | |
○ | PairlistSet::constructPairlist[...] | pairlist.cpp:4066 | libgromacs_mpi.so.9.0.0 |
○ | PairlistSets::construct(gmx::I[...] | pairlist.cpp:4322 | libgromacs_mpi.so.9.0.0 |
○ | nonbonded_verlet_t::constructP[...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | do_force(_IO_FILE*, t_commrec [...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | gmx::LegacySimulator::do_md() | md.cpp:1248 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:2311 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►3.85+ | __kmp_invoke_microtask | libomp.so | |
○ | __kmp_fork_call | libomp.so | |
○ | __kmpc_fork_call | libomp.so | |
○ | PairlistSet::constructPairlist[...] | pairlist.cpp:4066 | libgromacs_mpi.so.9.0.0 |
○ | PairlistSets::construct(gmx::I[...] | pairlist.cpp:4322 | libgromacs_mpi.so.9.0.0 |
○ | nonbonded_verlet_t::constructP[...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | do_force(_IO_FILE*, t_commrec [...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | gmx::LegacySimulator::do_md() | md.cpp:1248 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:2311 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
►3.85+ | __kmp_invoke_microtask | libomp.so | |
○ | __kmp_fork_call | libomp.so | |
○ | __kmpc_fork_call | libomp.so | |
○ | PairlistSet::constructPairlist[...] | pairlist.cpp:4066 | libgromacs_mpi.so.9.0.0 |
○ | PairlistSets::construct(gmx::I[...] | pairlist.cpp:4322 | libgromacs_mpi.so.9.0.0 |
○ | nonbonded_verlet_t::constructP[...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | do_force(_IO_FILE*, t_commrec [...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | gmx::LegacySimulator::do_md() | md.cpp:1248 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:2311 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
►2.56+ | __kmp_invoke_microtask | libomp.so | |
○ | __kmp_fork_call | libomp.so | |
○ | __kmpc_fork_call | libomp.so | |
○ | PairlistSet::constructPairlist[...] | pairlist.cpp:4066 | libgromacs_mpi.so.9.0.0 |
○ | PairlistSets::construct(gmx::I[...] | pairlist.cpp:4322 | libgromacs_mpi.so.9.0.0 |
○ | nonbonded_verlet_t::constructP[...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | do_force(_IO_FILE*, t_commrec [...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | gmx::LegacySimulator::do_md() | md.cpp:1248 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:2311 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
►2.56+ | __kmp_invoke_microtask | libomp.so | |
○ | __kmp_fork_call | libomp.so | |
○ | __kmpc_fork_call | libomp.so | |
○ | PairlistSet::constructPairlist[...] | pairlist.cpp:4066 | libgromacs_mpi.so.9.0.0 |
○ | PairlistSets::construct(gmx::I[...] | pairlist.cpp:4322 | libgromacs_mpi.so.9.0.0 |
○ | nonbonded_verlet_t::constructP[...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | do_force(_IO_FILE*, t_commrec [...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | gmx::LegacySimulator::do_md() | md.cpp:1248 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:2311 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
►1.28+ | __kmp_invoke_microtask | libomp.so | |
○ | __kmp_fork_call | libomp.so | |
○ | __kmpc_fork_call | libomp.so | |
○ | PairlistSet::constructPairlist[...] | pairlist.cpp:4066 | libgromacs_mpi.so.9.0.0 |
○ | PairlistSets::construct(gmx::I[...] | pairlist.cpp:4322 | libgromacs_mpi.so.9.0.0 |
○ | nonbonded_verlet_t::constructP[...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | do_force(_IO_FILE*, t_commrec [...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | gmx::LegacySimulator::do_md() | md.cpp:1248 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:2311 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
Coverage (%) | Name | Source Location | Module |
---|---|---|---|
►68.06+ | __kmp_invoke_microtask | libomp.so | |
○ | __kmp_fork_call | libomp.so | |
○ | __kmpc_fork_call | libomp.so | |
○ | PairlistSet::constructPairlist[...] | pairlist.cpp:4066 | libgromacs_mpi.so.9.0.0 |
○ | PairlistSets::construct(gmx::I[...] | pairlist.cpp:4322 | libgromacs_mpi.so.9.0.0 |
○ | nonbonded_verlet_t::constructP[...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | do_force(_IO_FILE*, t_commrec [...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | gmx::LegacySimulator::do_md() | md.cpp:1248 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:2311 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 | |
►31.94+ | __kmp_invoke_microtask | libomp.so | |
○ | __kmp_fork_call | libomp.so | |
○ | __kmpc_fork_call | libomp.so | |
○ | PairlistSet::constructPairlist[...] | pairlist.cpp:4066 | libgromacs_mpi.so.9.0.0 |
○ | PairlistSets::construct(gmx::I[...] | pairlist.cpp:4322 | libgromacs_mpi.so.9.0.0 |
○ | nonbonded_verlet_t::constructP[...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | do_force(_IO_FILE*, t_commrec [...] | unique_ptr.h:173 | libgromacs_mpi.so.9.0.0 |
○ | gmx::LegacySimulator::do_md() | md.cpp:1248 | libgromacs_mpi.so.9.0.0 |
○ | gmx::Mdrunner::mdrunner() | runner.cpp:2311 | libgromacs_mpi.so.9.0.0 |
○ | gmx::gmx_mdrun(int, gmx_hw_inf[...] | mdrun.cpp:280 | gmx_mpi |
○ | gmx::gmx_mdrun(int, char**) | mdrun.cpp:82 | gmx_mpi |
○ | gmx::CommandLineModuleManager:[...] | cmdlinemodulemanager.cpp:569 | libgromacs_mpi.so.9.0.0 |
○ | main | gmx.cpp:58 | gmx_mpi |
○ | __libc_start_call_main | libc.so.6 |
Path / |
Metric | Value |
---|---|
CQA speedup if no scalar integer | 1.00 |
CQA speedup if FP arith vectorized | 1.00 |
CQA speedup if fully vectorized | 6.67 |
CQA speedup if no inter-iteration dependency | NA |
CQA speedup if next bottleneck killed | 1.04 |
Bottlenecks | micro-operation queue, |
Function | .omp_outlined..9#0x65dd70 |
Source | listoflists.h:145-146,iterator_interface.hpp:459-459,pairlist.cpp:1390-1394,pairlist.cpp:1397-1397 |
Source loop unroll info | NA |
Source loop unroll confidence level | NA |
Unroll/vectorization loop type | NA |
Unroll factor | NA |
CQA cycles | 4.17 |
CQA cycles if no scalar integer | 4.17 |
CQA cycles if FP arith vectorized | 4.17 |
CQA cycles if fully vectorized | 0.63 |
Front-end cycles | 4.17 |
P0 cycles | 4.00 |
P1 cycles | 4.00 |
P2 cycles | 3.75 |
P3 cycles | 3.75 |
P4 cycles | 2.50 |
P5 cycles | 3.67 |
P6 cycles | 3.67 |
P7 cycles | 3.67 |
P8 cycles | 0.00 |
P9 cycles | 0.00 |
P10 cycles | 0.00 |
P11 cycles | 0.00 |
P12 cycles | 0.00 |
P13 cycles | 0.00 |
DIV/SQRT cycles | 0.00 |
Inter-iter dependencies cycles | NA |
FE+BE cycles (UFS) | NA |
Stall cycles (UFS) | NA |
Nb insns | 25.00 |
Nb uops | 25.00 |
Nb loads | 10.00 |
Nb stores | 1.00 |
Nb stack references | 7.00 |
FLOP/cycle | 0.00 |
Nb FLOP add-sub | 0.00 |
Nb FLOP mul | 0.00 |
Nb FLOP fma | 0.00 |
Nb FLOP div | 0.00 |
Nb FLOP rcp | 0.00 |
Nb FLOP sqrt | 0.00 |
Nb FLOP rsqrt | 0.00 |
Bytes/cycle | 12.72 |
Bytes prefetched | 0.00 |
Bytes loaded | 49.00 |
Bytes stored | 4.00 |
Stride 0 | NA |
Stride 1 | NA |
Stride n | NA |
Stride unknown | NA |
Stride indirect | NA |
Vectorization ratio all | 0.00 |
Vectorization ratio load | 0.00 |
Vectorization ratio store | 0.00 |
Vectorization ratio mul | 0.00 |
Vectorization ratio add_sub | 0.00 |
Vectorization ratio fma | NA |
Vectorization ratio div_sqrt | NA |
Vectorization ratio other | 0.00 |
Vector-efficiency ratio all | 6.25 |
Vector-efficiency ratio load | 6.25 |
Vector-efficiency ratio store | 6.25 |
Vector-efficiency ratio mul | 6.25 |
Vector-efficiency ratio add_sub | 6.25 |
Vector-efficiency ratio fma | NA |
Vector-efficiency ratio div_sqrt | NA |
Vector-efficiency ratio other | 6.25 |
Metric | Value |
---|---|
CQA speedup if no scalar integer | 1.00 |
CQA speedup if FP arith vectorized | 1.00 |
CQA speedup if fully vectorized | 6.67 |
CQA speedup if no inter-iteration dependency | NA |
CQA speedup if next bottleneck killed | 1.04 |
Bottlenecks | micro-operation queue, |
Function | .omp_outlined..9#0x65dd70 |
Source | listoflists.h:145-146,iterator_interface.hpp:459-459,pairlist.cpp:1390-1394,pairlist.cpp:1397-1397 |
Source loop unroll info | NA |
Source loop unroll confidence level | NA |
Unroll/vectorization loop type | NA |
Unroll factor | NA |
CQA cycles | 4.17 |
CQA cycles if no scalar integer | 4.17 |
CQA cycles if FP arith vectorized | 4.17 |
CQA cycles if fully vectorized | 0.63 |
Front-end cycles | 4.17 |
P0 cycles | 4.00 |
P1 cycles | 4.00 |
P2 cycles | 3.75 |
P3 cycles | 3.75 |
P4 cycles | 2.50 |
P5 cycles | 3.67 |
P6 cycles | 3.67 |
P7 cycles | 3.67 |
P8 cycles | 0.00 |
P9 cycles | 0.00 |
P10 cycles | 0.00 |
P11 cycles | 0.00 |
P12 cycles | 0.00 |
P13 cycles | 0.00 |
DIV/SQRT cycles | 0.00 |
Inter-iter dependencies cycles | NA |
FE+BE cycles (UFS) | NA |
Stall cycles (UFS) | NA |
Nb insns | 25.00 |
Nb uops | 25.00 |
Nb loads | 10.00 |
Nb stores | 1.00 |
Nb stack references | 7.00 |
FLOP/cycle | 0.00 |
Nb FLOP add-sub | 0.00 |
Nb FLOP mul | 0.00 |
Nb FLOP fma | 0.00 |
Nb FLOP div | 0.00 |
Nb FLOP rcp | 0.00 |
Nb FLOP sqrt | 0.00 |
Nb FLOP rsqrt | 0.00 |
Bytes/cycle | 12.72 |
Bytes prefetched | 0.00 |
Bytes loaded | 49.00 |
Bytes stored | 4.00 |
Stride 0 | NA |
Stride 1 | NA |
Stride n | NA |
Stride unknown | NA |
Stride indirect | NA |
Vectorization ratio all | 0.00 |
Vectorization ratio load | 0.00 |
Vectorization ratio store | 0.00 |
Vectorization ratio mul | 0.00 |
Vectorization ratio add_sub | 0.00 |
Vectorization ratio fma | NA |
Vectorization ratio div_sqrt | NA |
Vectorization ratio other | 0.00 |
Vector-efficiency ratio all | 6.25 |
Vector-efficiency ratio load | 6.25 |
Vector-efficiency ratio store | 6.25 |
Vector-efficiency ratio mul | 6.25 |
Vector-efficiency ratio add_sub | 6.25 |
Vector-efficiency ratio fma | NA |
Vector-efficiency ratio div_sqrt | NA |
Vector-efficiency ratio other | 6.25 |
Path / |
Function | .omp_outlined..9#0x65dd70 |
Source file and lines | pairlist.cpp:1330-1430 |
Module | libgromacs_mpi.so.9.0.0 |
nb instructions | 25 |
nb uops | 25 |
loop length | 113 |
used x86 registers | 10 |
used mmx registers | 0 |
used xmm registers | 0 |
used ymm registers | 0 |
used zmm registers | 0 |
nb stack references | 7 |
micro-operation queue | 4.17 cycles |
front end | 4.17 cycles |
ALU0/BRU0 | ALU1 | ALU2 | ALU3 | BRU1 | AGU0 | AGU1 | AGU2 | FP0 | FP1 | FP2 | FP3 | FP4 | FP5 | |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
uops | 4.00 | 4.00 | 3.75 | 3.75 | 2.50 | 3.67 | 3.67 | 3.67 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 |
cycles | 4.00 | 4.00 | 3.75 | 3.75 | 2.50 | 3.67 | 3.67 | 3.67 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 |
Cycles executing div or sqrt instructions | NA |
Front-end | 4.17 |
Dispatch | 4.00 |
Overall L1 | 4.17 |
all | 0% |
load | 0% |
store | 0% |
mul | 0% |
add-sub | 0% |
fma | NA (no fma vectorizable/vectorized instructions) |
div/sqrt | NA (no div/sqrt vectorizable/vectorized instructions) |
other | 0% |
all | 6% |
load | 6% |
store | 6% |
mul | 6% |
add-sub | 6% |
fma | NA (no fma vectorizable/vectorized instructions) |
div/sqrt | NA (no div/sqrt vectorizable/vectorized instructions) |
other | 6% |
Instruction | Nb FU | ALU0/BRU0 | ALU1 | ALU2 | ALU3 | BRU1 | AGU0 | AGU1 | AGU2 | FP0 | FP1 | FP2 | FP3 | FP4 | FP5 | Latency | Recip. throughput | Vectorization |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
INC %R13D | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.25 | scal (6.3%) |
MOV -0x40(%R15),%EAX | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 0.33 | scal (6.3%) |
CMP %EAX,%R13D | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.25 | scal (6.3%) |
JGE 660e40 <.omp_outlined..9+0x30d0> | 1 | 0.50 | 0 | 0 | 0 | 0.50 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50-1 | N/A |
IMUL 0x48(%RSP),%EAX | 1 | 0 | 1 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 1 | scal (6.3%) |
ADD %R13D,%EAX | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.25 | scal (6.3%) |
MOVSXD %EAX,%RCX | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.25 | N/A |
MOV 0xa8(%RSP),%RDX | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 0.33 | N/A |
MOV (%RDX,%RCX,4),%R9D | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 0.33 | N/A |
TEST %R9D,%R9D | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.25 | scal (6.3%) |
JS 660bd0 <.omp_outlined..9+0x2e60> | 1 | 0.50 | 0 | 0 | 0 | 0.50 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50-1 | N/A |
MOV 0xc8(%RSP),%RDX | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 0.33 | N/A |
MOVSXD (%RDX,%R9,4),%RCX | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.33 | N/A |
MOVSXD 0x4(%RDX,%R9,4),%RDX | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.33 | N/A |
CMP %EDX,%ECX | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.25 | scal (6.3%) |
JE 660bd0 <.omp_outlined..9+0x2e60> | 1 | 0.50 | 0 | 0 | 0 | 0.50 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50-1 | N/A |
MOV 0xc0(%RSP),%RSI | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 0.33 | N/A |
LEA (%RSI,%RDX,4),%R11 | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.25 | N/A |
LEA (%RSI,%RCX,4),%R14 | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.25 | N/A |
MOV 0x1d8(%RSP),%ECX | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 0.33 | N/A |
SHLX %ECX,%R13D,%ECX | 1 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | N/A |
MOV %ECX,0xd0(%RSP) | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 4 | 0.50 | scal (6.3%) |
CMPB $0,0x60(%RSP) | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.33 | N/A |
JE 660d6d <.omp_outlined..9+0x2ffd> | 1 | 0.50 | 0 | 0 | 0 | 0.50 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50-1 | N/A |
JMP 660c5d <.omp_outlined..9+0x2eed> | 1 | 0.50 | 0 | 0 | 0 | 0.50 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | N/A |
Function | .omp_outlined..9#0x65dd70 |
Source file and lines | pairlist.cpp:1330-1430 |
Module | libgromacs_mpi.so.9.0.0 |
nb instructions | 25 |
nb uops | 25 |
loop length | 113 |
used x86 registers | 10 |
used mmx registers | 0 |
used xmm registers | 0 |
used ymm registers | 0 |
used zmm registers | 0 |
nb stack references | 7 |
micro-operation queue | 4.17 cycles |
front end | 4.17 cycles |
ALU0/BRU0 | ALU1 | ALU2 | ALU3 | BRU1 | AGU0 | AGU1 | AGU2 | FP0 | FP1 | FP2 | FP3 | FP4 | FP5 | |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
uops | 4.00 | 4.00 | 3.75 | 3.75 | 2.50 | 3.67 | 3.67 | 3.67 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 |
cycles | 4.00 | 4.00 | 3.75 | 3.75 | 2.50 | 3.67 | 3.67 | 3.67 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 |
Cycles executing div or sqrt instructions | NA |
Front-end | 4.17 |
Dispatch | 4.00 |
Overall L1 | 4.17 |
all | 0% |
load | 0% |
store | 0% |
mul | 0% |
add-sub | 0% |
fma | NA (no fma vectorizable/vectorized instructions) |
div/sqrt | NA (no div/sqrt vectorizable/vectorized instructions) |
other | 0% |
all | 6% |
load | 6% |
store | 6% |
mul | 6% |
add-sub | 6% |
fma | NA (no fma vectorizable/vectorized instructions) |
div/sqrt | NA (no div/sqrt vectorizable/vectorized instructions) |
other | 6% |
Instruction | Nb FU | ALU0/BRU0 | ALU1 | ALU2 | ALU3 | BRU1 | AGU0 | AGU1 | AGU2 | FP0 | FP1 | FP2 | FP3 | FP4 | FP5 | Latency | Recip. throughput | Vectorization |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
INC %R13D | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.25 | scal (6.3%) |
MOV -0x40(%R15),%EAX | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 0.33 | scal (6.3%) |
CMP %EAX,%R13D | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.25 | scal (6.3%) |
JGE 660e40 <.omp_outlined..9+0x30d0> | 1 | 0.50 | 0 | 0 | 0 | 0.50 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50-1 | N/A |
IMUL 0x48(%RSP),%EAX | 1 | 0 | 1 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 1 | scal (6.3%) |
ADD %R13D,%EAX | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.25 | scal (6.3%) |
MOVSXD %EAX,%RCX | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.25 | N/A |
MOV 0xa8(%RSP),%RDX | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 0.33 | N/A |
MOV (%RDX,%RCX,4),%R9D | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 0.33 | N/A |
TEST %R9D,%R9D | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.25 | scal (6.3%) |
JS 660bd0 <.omp_outlined..9+0x2e60> | 1 | 0.50 | 0 | 0 | 0 | 0.50 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50-1 | N/A |
MOV 0xc8(%RSP),%RDX | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 0.33 | N/A |
MOVSXD (%RDX,%R9,4),%RCX | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.33 | N/A |
MOVSXD 0x4(%RDX,%R9,4),%RDX | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.33 | N/A |
CMP %EDX,%ECX | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.25 | scal (6.3%) |
JE 660bd0 <.omp_outlined..9+0x2e60> | 1 | 0.50 | 0 | 0 | 0 | 0.50 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50-1 | N/A |
MOV 0xc0(%RSP),%RSI | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 0.33 | N/A |
LEA (%RSI,%RDX,4),%R11 | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.25 | N/A |
LEA (%RSI,%RCX,4),%R14 | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.25 | N/A |
MOV 0x1d8(%RSP),%ECX | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 0.33 | N/A |
SHLX %ECX,%R13D,%ECX | 1 | 0 | 0.50 | 0.50 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | N/A |
MOV %ECX,0xd0(%RSP) | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 4 | 0.50 | scal (6.3%) |
CMPB $0,0x60(%RSP) | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.33 | N/A |
JE 660d6d <.omp_outlined..9+0x2ffd> | 1 | 0.50 | 0 | 0 | 0 | 0.50 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50-1 | N/A |
JMP 660c5d <.omp_outlined..9+0x2eed> | 1 | 0.50 | 0 | 0 | 0 | 0.50 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | N/A |
Run 1x1 | Number processes: 1Number processes per node: 1OMP_NUM_THREADS: 1 |
---|---|
Run 2x1 | Number processes: 2Number processes per node: 2OMP_NUM_THREADS: 1 |
Run 4x1 | Number processes: 4Number processes per node: 4OMP_NUM_THREADS: 1 |
Run 8x1 | Number processes: 8Number processes per node: 8OMP_NUM_THREADS: 1 |
Run 16x1 | Number processes: 16Number processes per node: 16OMP_NUM_THREADS: 1 |
Run 32x1 | Number processes: 32Number processes per node: 32OMP_NUM_THREADS: 1 |
Run 64x1 | Number processes: 64Number processes per node: 64OMP_NUM_THREADS: 1 |
Run 128x1 | Number processes: 128Number processes per node: 128OMP_NUM_THREADS: 1 |
Run 192x1 | Number processes: 192Number nodes: 1Number processes per node: 192Run Command: <executable> mdrun -s ion_channel.tpr -nsteps 10000 -pin on -deffnm aoccMPI Command: mpirun -genv I_MPI_FABRICS=shm -n <number_processes>Dataset: Run Directory: .OMP_NUM_THREADS: 1 |
(1x1) Efficiency | (1x1) Potential Speed-Up (%) | (2x1) Efficiency | (2x1) Potential Speed-Up (%) | (4x1) Efficiency | (4x1) Potential Speed-Up (%) | (8x1) Efficiency | (8x1) Potential Speed-Up (%) | (16x1) Efficiency | (16x1) Potential Speed-Up (%) | (32x1) Efficiency | (32x1) Potential Speed-Up (%) | (64x1) Efficiency | (64x1) Potential Speed-Up (%) | (128x1) Efficiency | (128x1) Potential Speed-Up (%) | (192x1) Efficiency | (192x1) Potential Speed-Up (%) |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
1 | 0 | 0.76 | 0 | 0.59 | 0.01 | 0.47 | 0.01 | 0.51 | 0.01 | 0.54 | 0.01 | 0.37 | 0.01 | 0.32 | 0.01 | 0.34 | 0.01 |
Run | Number of threads | Efficiency (ideal is 1) | Speedup | Ideal Speedup | Time (s) | Coverage (%) |
---|---|---|---|---|---|---|
1x1 | 1 | 1 | 1 | 1 | 0.12499997764826 | 0.014995116740465 |
2x1 | 2 | 0.76 | 1.51 | 2 | 0.094999991357327 | 0.018201071768999 |
4x1 | 4 | 0.59 | 2.38 | 4 | 0.074999988079071 | 0.021086037158966 |
8x1 | 8 | 0.47 | 3.77 | 8 | 0.064999990165234 | 0.021417111158371 |
16x1 | 16 | 0.51 | 8.13 | 16 | 0.03999999538064 | 0.018597390502691 |
32x1 | 20 | 0.54 | 17.37 | 32 | 0.029999997466803 | 0.014001447707415 |
64x1 | 32 | 0.37 | 23.45 | 64 | 0.029999997466803 | 0.013412419706583 |
128x1 | 48 | 0.32 | 40.44 | 128 | 0.019999999552965 | 0.018185690045357 |
192x1 | 56 | 0.34 | 66 | 192 | 0.019999995827675 | 0.014061571098864 |