Function: .omp_outlined.#0xbe5d40 | Module: libgromacs_mpi.so.9.0.0 | Source: listed_forces.cpp:387-451 [...] | Coverage (incl. loops): 0.01% | (excl. loops): 0.00% |
---|
Function: .omp_outlined.#0xbe5d40 | Module: libgromacs_mpi.so.9.0.0 | Source: listed_forces.cpp:387-451 [...] | Coverage (incl. loops): 0.01% | (excl. loops): 0.00% |
---|
/home/eoseret/gromacs-2024.2/src/gromacs/listed_forces/listed_forces.cpp: 387 - 451 |
-------------------------------------------------------------------------------- |
387: #pragma omp parallel for num_threads(bt->nthreads) schedule(static) |
388: for (int thread = 0; thread < bt->nthreads; thread++) |
389: { |
390: try |
391: { |
392: auto& threadBuffer = bt->threadedForceBuffer.threadForceBuffer(thread); |
[...] |
399: threadBuffer.clearForcesAndEnergies(); |
[...] |
406: if (thread == 0) |
407: { |
408: fshift = fshiftMainBuffer; |
409: epot = enerd->term; |
410: grpp = &enerd->grpp; |
411: dvdlt = dvdl; |
[...] |
421: for (int ftype = 0; (ftype < F_NRE); ftype++) |
422: { |
423: const InteractionList& ilist = idef.il[ftype]; |
424: if (!ilist.empty() && ftype_is_bonded_potential(ftype)) |
425: { |
426: ArrayRef<const int> iatoms = gmx::makeConstArrayRef(ilist.iatoms); |
427: |
428: real v = calc_one_bond(thread, |
429: ftype, |
430: idef, |
431: iatoms, |
432: idef.numNonperturbedInteractions[ftype], |
433: bt->workDivision, |
434: x, |
435: ft, |
436: fshift, |
437: fr, |
438: pbc_null, |
439: grpp, |
440: nrnb, |
[...] |
447: nPerturbed, |
448: fcd, |
449: stepWork, |
450: global_atom_index); |
451: epot[ftype] += v; |
/home/eoseret/gromacs-2024.2/src/gromacs/listed_forces/utilities.h: 56 - 57 |
-------------------------------------------------------------------------------- |
56: return ((interaction_function[ftype].flags & IF_BOND) != 0U) |
57: && !(ftype == F_CONNBONDS || ftype == F_POSRES || ftype == F_FBPOSRES); |
/usr/lib/gcc/x86_64-redhat-linux/11/../../../../include/c++/11/bits/stl_vector.h: 1046 - 1169 |
-------------------------------------------------------------------------------- |
1046: return *(this->_M_impl._M_start + __n); |
[...] |
1169: { return _M_data_ptr(this->_M_impl._M_start); } |
/usr/lib/gcc/x86_64-redhat-linux/11/../../../../include/c++/11/bits/stl_iterator.h: 1028 - 1166 |
-------------------------------------------------------------------------------- |
1028: : _M_current(__i) { } |
[...] |
1166: { return __lhs.base() == __rhs.base(); } |
/home/eoseret/gromacs-2024.2/api/legacy/include/gromacs/utility/arrayref.h: 72 - 180 |
-------------------------------------------------------------------------------- |
72: constexpr explicit ArrayRefIter(T* it) noexcept : it_(it) {} |
[...] |
78: constexpr T* data() const noexcept { return it_; } |
[...] |
85: constexpr auto operator-(ArrayRefIter other) const noexcept { return it_ - other.it_; } |
[...] |
180: ArrayRef(U&& o) : begin_(o.data()), end_(o.data() + o.size()) |
/usr/lib/gcc/x86_64-redhat-linux/11/../../../../include/c++/11/bits/unique_ptr.h: 173 - 173 |
-------------------------------------------------------------------------------- |
173: pointer _M_ptr() const { return std::get<0>(_M_t); } |
/home/eoseret/gromacs-2024.2/src/gromacs/mdtypes/threaded_force_buffer.h: 143 - 152 |
-------------------------------------------------------------------------------- |
143: ArrayRef<RVec> shiftForces() { return shiftForces_; } |
[...] |
149: gmx_grppairener_t& groupPairEnergies() { return groupPairEnergies_; } |
150: |
151: //! Returns a reference to the dvdl terms |
152: EnumerationArray<FreeEnergyPerturbationCouplingType, real>& dvdl() { return dvdl_; } |
0xbe5d40 PUSH %RBP |
0xbe5d41 MOV %RSP,%RBP |
0xbe5d44 PUSH %R15 |
0xbe5d46 PUSH %R14 |
0xbe5d48 PUSH %R13 |
0xbe5d4a PUSH %R12 |
0xbe5d4c PUSH %RBX |
0xbe5d4d SUB $0x168,%RSP |
0xbe5d54 MOV %R9,-0x80(%RBP) |
0xbe5d58 MOV %R8,-0x78(%RBP) |
0xbe5d5c MOV %RCX,-0x70(%RBP) |
0xbe5d60 MOV %RDX,-0x68(%RBP) |
0xbe5d64 MOV (%RDX),%RAX |
0xbe5d67 MOV (%RAX),%EBX |
0xbe5d69 TEST %EBX,%EBX |
0xbe5d6b JLE be5de3 |
0xbe5d6d DEC %EBX |
0xbe5d6f MOVL $0,-0x30(%RBP) |
0xbe5d76 MOV %EBX,-0x2c(%RBP) |
0xbe5d79 MOVL $0x1,-0x40(%RBP) |
0xbe5d80 MOVL $0,-0x3c(%RBP) |
0xbe5d87 MOV (%RDI),%ESI |
0xbe5d89 LEA -0x40(%RBP),%RAX |
0xbe5d8d MOV %RAX,(%RSP) |
0xbe5d91 MOVL $0x1,0x10(%RSP) |
0xbe5d99 MOVL $0x1,0x8(%RSP) |
0xbe5da1 LEA 0x3f8890(%RIP),%RDI |
0xbe5da8 LEA -0x3c(%RBP),%RCX |
0xbe5dac LEA -0x30(%RBP),%R8 |
0xbe5db0 LEA -0x2c(%RBP),%R9 |
0xbe5db4 MOV %ESI,-0x34(%RBP) |
0xbe5db7 MOV $0x22,%EDX |
0xbe5dbc CALL fa67e0 <@plt_start@+0x3330> |
0xbe5dc1 MOV -0x2c(%RBP),%EAX |
0xbe5dc4 CMP %EBX,%EAX |
0xbe5dc6 CMOVL %EAX,%EBX |
0xbe5dc9 MOV %EBX,-0x2c(%RBP) |
0xbe5dcc MOVSXD -0x30(%RBP),%RAX |
0xbe5dd0 CMP %EBX,%EAX |
0xbe5dd2 JLE be5df5 |
0xbe5dd4 LEA 0x3f8875(%RIP),%RDI |
0xbe5ddb MOV -0x34(%RBP),%ESI |
0xbe5dde CALL fa67f0 <@plt_start@+0x3340> |
0xbe5de3 ADD $0x168,%RSP |
0xbe5dea POP %RBX |
0xbe5deb POP %R12 |
0xbe5ded POP %R13 |
0xbe5def POP %R14 |
0xbe5df1 POP %R15 |
0xbe5df3 POP %RBP |
0xbe5df4 RET |
0xbe5df5 MOV %RAX,%RBX |
0xbe5df8 MOV 0x10(%RBP),%R14 |
0xbe5dfc JMP be5e10 |
(1417) 0xbe5e00 LEA 0x1(%RBX),%RAX |
(1417) 0xbe5e04 MOVSXD -0x2c(%RBP),%RCX |
(1417) 0xbe5e08 CMP %RCX,%RBX |
(1417) 0xbe5e0b MOV %RAX,%RBX |
(1417) 0xbe5e0e JGE be5dd4 |
(1417) 0xbe5e10 MOV -0x68(%RBP),%RAX |
(1417) 0xbe5e14 MOV (%RAX),%RAX |
(1417) 0xbe5e17 MOV 0x10(%RAX),%RAX |
(1417) 0xbe5e1b MOV (%RAX,%RBX,8),%R15 |
(1417) 0xbe5e1f MOV %R15,%RDI |
(1417) 0xbe5e22 CALL faab80 <@plt_start@+0x76d0> |
(1417) 0xbe5e27 TEST %RBX,%RBX |
(1417) 0xbe5e2a JE be5e60 |
(1417) 0xbe5e2c LEA 0x50(%R15),%RAX |
(1417) 0xbe5e30 MOV 0x68(%R15),%RCX |
(1417) 0xbe5e34 MOV %RCX,-0x48(%RBP) |
(1417) 0xbe5e38 LEA 0x80(%R15),%RCX |
(1417) 0xbe5e3f MOV %RCX,-0x60(%RBP) |
(1417) 0xbe5e43 LEA 0x100(%R15),%RCX |
(1417) 0xbe5e4a MOV %RCX,-0x58(%RBP) |
(1417) 0xbe5e4e LEA 0x11c(%R15),%RCX |
(1417) 0xbe5e55 MOV %RCX,-0x50(%RBP) |
(1417) 0xbe5e59 JMP be5e8c |
(1417) 0xbe5e60 MOV -0x78(%RBP),%RAX |
(1417) 0xbe5e64 MOV (%RAX),%RAX |
(1417) 0xbe5e67 MOV %RAX,-0x48(%RBP) |
(1417) 0xbe5e6b ADD $0x178,%RAX |
(1417) 0xbe5e71 MOV %RAX,-0x60(%RBP) |
(1417) 0xbe5e75 MOV -0x80(%RBP),%RAX |
(1417) 0xbe5e79 MOV (%RAX),%RCX |
(1417) 0xbe5e7c MOV %RCX,-0x58(%RBP) |
(1417) 0xbe5e80 MOV 0x8(%RAX),%RAX |
(1417) 0xbe5e84 MOV %RAX,-0x50(%RBP) |
(1417) 0xbe5e88 MOV -0x70(%RBP),%RAX |
(1417) 0xbe5e8c MOV 0x419535(%RIP),%RDX |
(1417) 0xbe5e93 MOV $0x30000000000010,%RSI |
(1417) 0xbe5e9d MOV (%R15),%RCX |
(1417) 0xbe5ea0 MOV %RCX,-0x90(%RBP) |
(1417) 0xbe5ea7 MOV (%RAX),%RAX |
(1417) 0xbe5eaa MOV %RAX,-0x88(%RBP) |
(1417) 0xbe5eb1 XOR %R15D,%R15D |
(1417) 0xbe5eb4 MOV $-0x234,%R12 |
(1417) 0xbe5ebb XOR %R13D,%R13D |
(1417) 0xbe5ebe JMP be6068 |
(1418) 0xbe5ec3 MOV 0x910(%R14,%R13,1),%EAX |
(1418) 0xbe5ecb MOV %EAX,-0x38(%RBP) |
(1418) 0xbe5ece MOV -0x68(%RBP),%RAX |
(1418) 0xbe5ed2 MOV (%RAX),%R10 |
(1418) 0xbe5ed5 MOV 0x18(%RBP),%RAX |
(1418) 0xbe5ed9 MOV (%RAX),%RAX |
(1418) 0xbe5edc MOV %RAX,-0xa0(%RBP) |
(1418) 0xbe5ee3 MOV 0x20(%RBP),%RAX |
(1418) 0xbe5ee7 MOV (%RAX),%RAX |
(1418) 0xbe5eea MOV %RAX,-0x98(%RBP) |
(1418) 0xbe5ef1 MOV 0x28(%RBP),%RAX |
(1418) 0xbe5ef5 MOV (%RAX),%R9 |
(1418) 0xbe5ef8 MOV 0x30(%RBP),%RAX |
(1418) 0xbe5efc MOV (%RAX),%RDI |
(1418) 0xbe5eff MOV 0x38(%RBP),%RAX |
(1418) 0xbe5f03 MOV (%RAX),%R11 |
(1418) 0xbe5f06 MOV %R11,-0xc0(%RBP) |
(1418) 0xbe5f0d MOV 0x8(%RAX),%R11 |
(1418) 0xbe5f11 MOV %R11,-0xb8(%RBP) |
(1418) 0xbe5f18 MOV -0x58(%RBP),%RAX |
(1418) 0xbe5f1c MOV %RAX,-0xb0(%RBP) |
(1418) 0xbe5f23 MOV -0x50(%RBP),%RAX |
(1418) 0xbe5f27 MOV %RAX,-0xa8(%RBP) |
(1418) 0xbe5f2e MOV 0x40(%RBP),%RAX |
(1418) 0xbe5f32 VMOVUPS (%RAX),%XMM0 |
(1418) 0xbe5f36 MOV 0x48(%RBP),%RAX |
(1418) 0xbe5f3a VMOVUPS (%RAX),%XMM1 |
(1418) 0xbe5f3e MOV 0x50(%RBP),%RAX |
(1418) 0xbe5f42 VMOVUPS (%RAX),%XMM2 |
(1418) 0xbe5f46 MOV 0x58(%RBP),%RAX |
(1418) 0xbe5f4a VMOVUPS (%RAX),%XMM3 |
(1418) 0xbe5f4e MOV 0x60(%RBP),%RAX |
(1418) 0xbe5f52 MOV (%RAX),%R11D |
(1418) 0xbe5f55 MOV %RBX,%RDX |
(1418) 0xbe5f58 MOV 0x68(%RBP),%RAX |
(1418) 0xbe5f5c MOV (%RAX),%RBX |
(1418) 0xbe5f5f MOV 0x78(%RBP),%RAX |
(1418) 0xbe5f63 MOV (%RAX),%RAX |
(1418) 0xbe5f66 MOV 0x60(%R10),%ESI |
(1418) 0xbe5f6a MOV 0x68(%R10),%R10 |
(1418) 0xbe5f6e VMOVUPS -0xb0(%RBP),%XMM4 |
(1418) 0xbe5f76 VMOVUPS %XMM4,0x58(%RSP) |
(1418) 0xbe5f7c VMOVUPS -0xc0(%RBP),%XMM4 |
(1418) 0xbe5f84 VMOVUPS %XMM4,0x48(%RSP) |
(1418) 0xbe5f8a MOV %RAX,0xc0(%RSP) |
(1418) 0xbe5f92 MOV %RBX,0xb0(%RSP) |
(1418) 0xbe5f9a MOV %RDX,%RBX |
(1418) 0xbe5f9d MOV %R11D,0xa8(%RSP) |
(1418) 0xbe5fa5 MOV %RDI,0x40(%RSP) |
(1418) 0xbe5faa MOV %R9,0x30(%RSP) |
(1418) 0xbe5faf MOV -0x98(%RBP),%RAX |
(1418) 0xbe5fb6 MOV %RAX,0x28(%RSP) |
(1418) 0xbe5fbb MOV -0xa0(%RBP),%RAX |
(1418) 0xbe5fc2 MOV %RAX,0x10(%RSP) |
(1418) 0xbe5fc7 MOV %R10,0x8(%RSP) |
(1418) 0xbe5fcc MOV 0x70(%RBP),%RAX |
(1418) 0xbe5fd0 MOV %RAX,0xb8(%RSP) |
(1418) 0xbe5fd8 VMOVUPS %XMM3,0x98(%RSP) |
(1418) 0xbe5fe1 VMOVUPS %XMM2,0x88(%RSP) |
(1418) 0xbe5fea VMOVUPS %XMM1,0x78(%RSP) |
(1418) 0xbe5ff0 VMOVUPS %XMM0,0x68(%RSP) |
(1418) 0xbe5ff6 MOV -0x60(%RBP),%RAX |
(1418) 0xbe5ffa MOV %RAX,0x38(%RSP) |
(1418) 0xbe5fff MOV -0x88(%RBP),%RAX |
(1418) 0xbe6006 MOV %RAX,0x20(%RSP) |
(1418) 0xbe600b MOV -0x90(%RBP),%RAX |
(1418) 0xbe6012 MOV %RAX,0x18(%RSP) |
(1418) 0xbe6017 MOV %ESI,(%RSP) |
(1418) 0xbe601a MOV %EBX,%EDI |
(1418) 0xbe601c MOV %R15D,%ESI |
(1418) 0xbe601f MOV -0x38(%RBP),%R9D |
(1418) 0xbe6023 MOV %R14,%RDX |
(1418) 0xbe6026 CALL be59d0 <_ZN12_GLOBAL__N_113calc_one_bondEiiRK22InteractionDefinitionsN3gmx8ArrayRefIKiEEiRK12WorkDivisionPA3_KfPA4_fPA3_fPK10t_forcerecPK5t_pbcP17gmx_grppairener_tP6t_nrnbNS4_ISA_EENS4_IfEESR_SR_NS4_IKbEENS4_IKtEEiP8t_fcdataRKNS3_12StepWorkloadEPi> |
(1418) 0xbe602b MOV -0x48(%RBP),%RAX |
(1418) 0xbe602f VADDSS (%RAX,%R13,1),%XMM0,%XMM0 |
(1418) 0xbe6035 VMOVSS %XMM0,(%RAX,%R13,1) |
(1418) 0xbe603b MOV 0x419386(%RIP),%RDX |
(1418) 0xbe6042 MOV $0x30000000000010,%RSI |
(1418) 0xbe604c NOPL (%RAX) |
(1418) 0xbe6050 ADD $0x4,%R13 |
(1418) 0xbe6054 INC %R15D |
(1418) 0xbe6057 ADD $0x6,%R12 |
(1418) 0xbe605b CMP $0x178,%R13 |
(1418) 0xbe6062 JE be5e00 |
(1418) 0xbe6068 MOV 0x910(%R14,%R12,4),%RCX |
(1418) 0xbe6070 MOV 0x918(%R14,%R12,4),%R8 |
(1418) 0xbe6078 CMP %R8,%RCX |
(1418) 0xbe607b JE be6050 |
(1418) 0xbe607d TESTB $0x1,0x1c(%RDX,%R13,8) |
(1418) 0xbe6083 JE be6050 |
(1418) 0xbe6085 CMP $0x35,%R15D |
(1418) 0xbe6089 JA be5ec3 |
(1418) 0xbe608f MOV %R15D,%EAX |
(1418) 0xbe6092 BT %RAX,%RSI |
(1418) 0xbe6096 JB be6050 |
(1418) 0xbe6098 JMP be5ec3 |
Coverage (%) | Name | Source Location | Module |
---|---|---|---|
►100.00+ | __kmp_invoke_microtask | libomp.so | |
○ | __kmp_fork_call | libomp.so | |
○ | __kmpc_fork_call | libomp.so | |
○ | ListedForces::calculate(gmx_wa[...] | listed_forces.cpp:387 | libgromacs_mpi.so.9.0.0 |
○ | do_force(_IO_FILE*, t_commrec [...] | sim_util.cpp:2047 | 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 |
---|---|---|---|
►66.67+ | __kmp_invoke_microtask | libomp.so | |
○ | __kmp_fork_call | libomp.so | |
○ | __kmpc_fork_call | libomp.so | |
○ | ListedForces::calculate(gmx_wa[...] | listed_forces.cpp:387 | libgromacs_mpi.so.9.0.0 |
○ | do_force(_IO_FILE*, t_commrec [...] | sim_util.cpp:2047 | 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 | |
►33.33+ | __kmp_fork_call | libomp.so | |
○ | __kmpc_fork_call | libomp.so | |
○ | ListedForces::calculate(gmx_wa[...] | listed_forces.cpp:387 | libgromacs_mpi.so.9.0.0 |
○ | do_force(_IO_FILE*, t_commrec [...] | sim_util.cpp:2047 | 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 |
---|---|---|---|
►100.00+ | __kmp_invoke_microtask | libomp.so | |
○ | __kmp_fork_call | libomp.so | |
○ | __kmpc_fork_call | libomp.so | |
○ | ListedForces::calculate(gmx_wa[...] | listed_forces.cpp:387 | libgromacs_mpi.so.9.0.0 |
○ | do_force(_IO_FILE*, t_commrec [...] | sim_util.cpp:2047 | 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 |
---|---|---|---|
►62.50+ | __kmp_invoke_microtask | libomp.so | |
○ | __kmp_fork_call | libomp.so | |
○ | __kmpc_fork_call | libomp.so | |
○ | ListedForces::calculate(gmx_wa[...] | listed_forces.cpp:387 | libgromacs_mpi.so.9.0.0 |
○ | do_force(_IO_FILE*, t_commrec [...] | sim_util.cpp:2047 | 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 | |
►20.83+ | __kmp_invoke_microtask | libomp.so | |
○ | __kmp_fork_call | libomp.so | |
○ | __kmpc_fork_call | libomp.so | |
○ | ListedForces::calculate(gmx_wa[...] | listed_forces.cpp:387 | libgromacs_mpi.so.9.0.0 |
○ | do_force(_IO_FILE*, t_commrec [...] | sim_util.cpp:2047 | 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 |
►16.67+ | __kmp_invoke_microtask | libomp.so | |
○ | __kmp_fork_call | libomp.so | |
○ | __kmpc_fork_call | libomp.so | |
○ | ListedForces::calculate(gmx_wa[...] | listed_forces.cpp:387 | libgromacs_mpi.so.9.0.0 |
○ | do_force(_IO_FILE*, t_commrec [...] | sim_util.cpp:2047 | 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 |
Coverage (%) | Name | Source Location | Module |
---|---|---|---|
►72.73+ | __kmp_invoke_microtask | libomp.so | |
○ | __kmp_fork_call | libomp.so | |
○ | __kmpc_fork_call | libomp.so | |
○ | ListedForces::calculate(gmx_wa[...] | listed_forces.cpp:387 | libgromacs_mpi.so.9.0.0 |
○ | do_force(_IO_FILE*, t_commrec [...] | sim_util.cpp:2047 | 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 | |
►22.73+ | __kmp_invoke_microtask | libomp.so | |
○ | __kmp_fork_call | libomp.so | |
○ | __kmpc_fork_call | libomp.so | |
○ | ListedForces::calculate(gmx_wa[...] | listed_forces.cpp:387 | libgromacs_mpi.so.9.0.0 |
○ | do_force(_IO_FILE*, t_commrec [...] | sim_util.cpp:2047 | 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 |
►4.55+ | __kmp_invoke_microtask | libomp.so | |
○ | __kmp_fork_call | libomp.so | |
○ | __kmpc_fork_call | libomp.so | |
○ | ListedForces::calculate(gmx_wa[...] | listed_forces.cpp:387 | libgromacs_mpi.so.9.0.0 |
○ | do_force(_IO_FILE*, t_commrec [...] | sim_util.cpp:2047 | 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 |
---|---|---|---|
►70.59+ | __kmp_invoke_microtask | libomp.so | |
○ | __kmp_fork_call | libomp.so | |
○ | __kmpc_fork_call | libomp.so | |
○ | ListedForces::calculate(gmx_wa[...] | listed_forces.cpp:387 | libgromacs_mpi.so.9.0.0 |
○ | do_force(_IO_FILE*, t_commrec [...] | sim_util.cpp:2047 | 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 | |
►17.65+ | __kmp_invoke_microtask | libomp.so | |
○ | __kmp_fork_call | libomp.so | |
○ | __kmpc_fork_call | libomp.so | |
○ | ListedForces::calculate(gmx_wa[...] | listed_forces.cpp:387 | libgromacs_mpi.so.9.0.0 |
○ | do_force(_IO_FILE*, t_commrec [...] | sim_util.cpp:2047 | 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 |
►5.88+ | __kmp_fork_call | libomp.so | |
○ | __kmpc_fork_call | libomp.so | |
○ | ListedForces::calculate(gmx_wa[...] | listed_forces.cpp:387 | libgromacs_mpi.so.9.0.0 |
○ | do_force(_IO_FILE*, t_commrec [...] | sim_util.cpp:2047 | 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 | |
►5.88+ | __kmp_invoke_microtask | libomp.so | |
○ | __kmp_fork_call | libomp.so | |
○ | __kmpc_fork_call | libomp.so | |
○ | ListedForces::calculate(gmx_wa[...] | listed_forces.cpp:387 | libgromacs_mpi.so.9.0.0 |
○ | do_force(_IO_FILE*, t_commrec [...] | sim_util.cpp:2047 | 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 |
---|---|---|---|
►100.00+ | __kmp_invoke_microtask | libomp.so | |
○ | __kmp_fork_call | libomp.so | |
○ | __kmpc_fork_call | libomp.so | |
○ | ListedForces::calculate(gmx_wa[...] | listed_forces.cpp:387 | libgromacs_mpi.so.9.0.0 |
○ | do_force(_IO_FILE*, t_commrec [...] | sim_util.cpp:2047 | 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 |
---|---|---|---|
►82.93+ | __kmp_invoke_microtask | libomp.so | |
○ | __kmp_fork_call | libomp.so | |
○ | __kmpc_fork_call | libomp.so | |
○ | ListedForces::calculate(gmx_wa[...] | listed_forces.cpp:387 | libgromacs_mpi.so.9.0.0 |
○ | do_force(_IO_FILE*, t_commrec [...] | sim_util.cpp:2047 | 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 | |
►7.32+ | __kmp_invoke_microtask | libomp.so | |
○ | __kmp_fork_call | libomp.so | |
○ | __kmpc_fork_call | libomp.so | |
○ | ListedForces::calculate(gmx_wa[...] | listed_forces.cpp:387 | libgromacs_mpi.so.9.0.0 |
○ | do_force(_IO_FILE*, t_commrec [...] | sim_util.cpp:2047 | 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 |
►4.88+ | __kmp_invoke_microtask | libomp.so | |
○ | __kmp_fork_call | libomp.so | |
○ | __kmpc_fork_call | libomp.so | |
○ | ListedForces::calculate(gmx_wa[...] | listed_forces.cpp:387 | libgromacs_mpi.so.9.0.0 |
○ | do_force(_IO_FILE*, t_commrec [...] | sim_util.cpp:2047 | 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 |
►2.44+ | __kmp_fork_call | libomp.so | |
○ | __kmpc_fork_call | libomp.so | |
○ | ListedForces::calculate(gmx_wa[...] | listed_forces.cpp:387 | libgromacs_mpi.so.9.0.0 |
○ | do_force(_IO_FILE*, t_commrec [...] | sim_util.cpp:2047 | 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 | |
►2.44+ | __kmp_fork_call | libomp.so | |
○ | __kmpc_fork_call | libomp.so | |
○ | ListedForces::calculate(gmx_wa[...] | listed_forces.cpp:387 | libgromacs_mpi.so.9.0.0 |
○ | do_force(_IO_FILE*, t_commrec [...] | sim_util.cpp:2047 | 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 |
---|---|---|---|
►91.38+ | __kmp_invoke_microtask | libomp.so | |
○ | __kmp_fork_call | libomp.so | |
○ | __kmpc_fork_call | libomp.so | |
○ | ListedForces::calculate(gmx_wa[...] | listed_forces.cpp:387 | libgromacs_mpi.so.9.0.0 |
○ | do_force(_IO_FILE*, t_commrec [...] | sim_util.cpp:2047 | 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 | |
►8.62+ | __kmp_fork_call | libomp.so | |
○ | __kmpc_fork_call | libomp.so | |
○ | ListedForces::calculate(gmx_wa[...] | listed_forces.cpp:387 | libgromacs_mpi.so.9.0.0 |
○ | do_force(_IO_FILE*, t_commrec [...] | sim_util.cpp:2047 | 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 / |
The code analyzed by CQA in that panel excludes loops and represents 0.00% of application time for run 1x1
Source file and lines | listed_forces.cpp:387-451 |
Module | libgromacs_mpi.so.9.0.0 |
nb instructions | 54 |
nb uops | 56 |
loop length | 190 |
used x86 registers | 14 |
used mmx registers | 0 |
used xmm registers | 0 |
used ymm registers | 0 |
used zmm registers | 0 |
nb stack references | 13 |
micro-operation queue | 9.33 cycles |
front end | 9.33 cycles |
ALU0/BRU0 | ALU1 | ALU2 | ALU3 | BRU1 | AGU0 | AGU1 | AGU2 | FP0 | FP1 | FP2 | FP3 | FP4 | FP5 | |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
uops | 4.50 | 4.50 | 4.50 | 4.50 | 3.00 | 7.33 | 7.33 | 7.33 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 |
cycles | 4.50 | 4.50 | 4.50 | 4.50 | 3.00 | 7.33 | 7.33 | 7.33 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 |
Cycles executing div or sqrt instructions | NA |
Front-end | 9.33 |
Dispatch | 7.33 |
Overall L1 | 9.33 |
all | 0% |
load | 0% |
store | 0% |
mul | NA (no mul vectorizable/vectorized instructions) |
add-sub | 0% |
fma | NA (no fma vectorizable/vectorized instructions) |
div/sqrt | NA (no div/sqrt vectorizable/vectorized instructions) |
other | 0% |
all | 8% |
load | 7% |
store | 8% |
mul | NA (no mul vectorizable/vectorized instructions) |
add-sub | 6% |
fma | NA (no fma vectorizable/vectorized instructions) |
div/sqrt | NA (no div/sqrt vectorizable/vectorized instructions) |
other | 7% |
Instruction | Nb FU | ALU0/BRU0 | ALU1 | ALU2 | ALU3 | BRU1 | AGU0 | AGU1 | AGU2 | FP0 | FP1 | FP2 | FP3 | FP4 | FP5 | Latency | Recip. throughput | Vectorization |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
PUSH %RBP | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | N/A |
MOV %RSP,%RBP | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.17 | N/A |
PUSH %R15 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | N/A |
PUSH %R14 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | N/A |
PUSH %R13 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | N/A |
PUSH %R12 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | N/A |
PUSH %RBX | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | N/A |
SUB $0x168,%RSP | 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 %R9,-0x80(%RBP) | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 4 | 0.50 | scal (12.5%) |
MOV %R8,-0x78(%RBP) | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 4 | 0.50 | scal (12.5%) |
MOV %RCX,-0x70(%RBP) | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 4 | 0.50 | scal (12.5%) |
MOV %RDX,-0x68(%RBP) | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 4 | 0.50 | scal (12.5%) |
MOV (%RDX),%RAX | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 0.33 | N/A |
MOV (%RAX),%EBX | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 0.33 | scal (6.3%) |
TEST %EBX,%EBX | 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%) |
JLE be5de3 <.omp_outlined.+0xa3> | 1 | 0.50 | 0 | 0 | 0 | 0.50 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50-1 | N/A |
DEC %EBX | 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%) |
MOVL $0,-0x30(%RBP) | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 4 | 0.50 | scal (6.3%) |
MOV %EBX,-0x2c(%RBP) | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 4 | 0.50 | scal (6.3%) |
MOVL $0x1,-0x40(%RBP) | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 4 | 0.50 | scal (6.3%) |
MOVL $0,-0x3c(%RBP) | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 4 | 0.50 | scal (6.3%) |
MOV (%RDI),%ESI | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 0.33 | scal (6.3%) |
LEA -0x40(%RBP),%RAX | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.25 | N/A |
MOV %RAX,(%RSP) | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 4 | 0.50 | scal (12.5%) |
MOVL $0x1,0x10(%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%) |
MOVL $0x1,0x8(%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%) |
LEA 0x3f8890(%RIP),%RDI | 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 -0x3c(%RBP),%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 |
LEA -0x30(%RBP),%R8 | 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 -0x2c(%RBP),%R9 | 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 %ESI,-0x34(%RBP) | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 4 | 0.50 | scal (6.3%) |
MOV $0x22,%EDX | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.25 | N/A |
CALL fa67e0 <@plt_start@+0x3330> | 2 | 0.50 | 0 | 0 | 0 | 0.50 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | N/A |
MOV -0x2c(%RBP),%EAX | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 0.33 | N/A |
CMP %EBX,%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%) |
CMOVL %EAX,%EBX | 1 | 0.50 | 0 | 0 | 0.50 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | scal (6.3%) |
MOV %EBX,-0x2c(%RBP) | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 4 | 0.50 | scal (6.3%) |
MOVSXD -0x30(%RBP),%RAX | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.33 | N/A |
CMP %EBX,%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%) |
JLE be5df5 <.omp_outlined.+0xb5> | 1 | 0.50 | 0 | 0 | 0 | 0.50 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50-1 | N/A |
LEA 0x3f8875(%RIP),%RDI | 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 -0x34(%RBP),%ESI | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 0.33 | scal (6.3%) |
CALL fa67f0 <@plt_start@+0x3340> | 2 | 0.50 | 0 | 0 | 0 | 0.50 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | N/A |
ADD $0x168,%RSP | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.25 | N/A |
POP %RBX | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.33 | N/A |
POP %R12 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.33 | N/A |
POP %R13 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.33 | N/A |
POP %R14 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.33 | N/A |
POP %R15 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.33 | N/A |
POP %RBP | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.33 | N/A |
RET | 1 | 0.50 | 0 | 0 | 0 | 0.50 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | N/A |
MOV %RAX,%RBX | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.17 | scal (12.5%) |
MOV 0x10(%RBP),%R14 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 0.33 | scal (12.5%) |
JMP be5e10 <.omp_outlined.+0xd0> | 1 | 0.50 | 0 | 0 | 0 | 0.50 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | N/A |
The code analyzed by CQA in that panel excludes loops and represents 0.00% of application time for run 1x1
Source file and lines | listed_forces.cpp:387-451 |
Module | libgromacs_mpi.so.9.0.0 |
nb instructions | 54 |
nb uops | 56 |
loop length | 190 |
used x86 registers | 14 |
used mmx registers | 0 |
used xmm registers | 0 |
used ymm registers | 0 |
used zmm registers | 0 |
nb stack references | 13 |
micro-operation queue | 9.33 cycles |
front end | 9.33 cycles |
ALU0/BRU0 | ALU1 | ALU2 | ALU3 | BRU1 | AGU0 | AGU1 | AGU2 | FP0 | FP1 | FP2 | FP3 | FP4 | FP5 | |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
uops | 4.50 | 4.50 | 4.50 | 4.50 | 3.00 | 7.33 | 7.33 | 7.33 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 |
cycles | 4.50 | 4.50 | 4.50 | 4.50 | 3.00 | 7.33 | 7.33 | 7.33 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 | 0.00 |
Cycles executing div or sqrt instructions | NA |
Front-end | 9.33 |
Dispatch | 7.33 |
Overall L1 | 9.33 |
all | 0% |
load | 0% |
store | 0% |
mul | NA (no mul vectorizable/vectorized instructions) |
add-sub | 0% |
fma | NA (no fma vectorizable/vectorized instructions) |
div/sqrt | NA (no div/sqrt vectorizable/vectorized instructions) |
other | 0% |
all | 8% |
load | 7% |
store | 8% |
mul | NA (no mul vectorizable/vectorized instructions) |
add-sub | 6% |
fma | NA (no fma vectorizable/vectorized instructions) |
div/sqrt | NA (no div/sqrt vectorizable/vectorized instructions) |
other | 7% |
Instruction | Nb FU | ALU0/BRU0 | ALU1 | ALU2 | ALU3 | BRU1 | AGU0 | AGU1 | AGU2 | FP0 | FP1 | FP2 | FP3 | FP4 | FP5 | Latency | Recip. throughput | Vectorization |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
PUSH %RBP | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | N/A |
MOV %RSP,%RBP | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.17 | N/A |
PUSH %R15 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | N/A |
PUSH %R14 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | N/A |
PUSH %R13 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | N/A |
PUSH %R12 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | N/A |
PUSH %RBX | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | N/A |
SUB $0x168,%RSP | 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 %R9,-0x80(%RBP) | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 4 | 0.50 | scal (12.5%) |
MOV %R8,-0x78(%RBP) | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 4 | 0.50 | scal (12.5%) |
MOV %RCX,-0x70(%RBP) | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 4 | 0.50 | scal (12.5%) |
MOV %RDX,-0x68(%RBP) | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 4 | 0.50 | scal (12.5%) |
MOV (%RDX),%RAX | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 0.33 | N/A |
MOV (%RAX),%EBX | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 0.33 | scal (6.3%) |
TEST %EBX,%EBX | 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%) |
JLE be5de3 <.omp_outlined.+0xa3> | 1 | 0.50 | 0 | 0 | 0 | 0.50 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50-1 | N/A |
DEC %EBX | 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%) |
MOVL $0,-0x30(%RBP) | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 4 | 0.50 | scal (6.3%) |
MOV %EBX,-0x2c(%RBP) | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 4 | 0.50 | scal (6.3%) |
MOVL $0x1,-0x40(%RBP) | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 4 | 0.50 | scal (6.3%) |
MOVL $0,-0x3c(%RBP) | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 4 | 0.50 | scal (6.3%) |
MOV (%RDI),%ESI | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 0.33 | scal (6.3%) |
LEA -0x40(%RBP),%RAX | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.25 | N/A |
MOV %RAX,(%RSP) | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 4 | 0.50 | scal (12.5%) |
MOVL $0x1,0x10(%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%) |
MOVL $0x1,0x8(%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%) |
LEA 0x3f8890(%RIP),%RDI | 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 -0x3c(%RBP),%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 |
LEA -0x30(%RBP),%R8 | 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 -0x2c(%RBP),%R9 | 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 %ESI,-0x34(%RBP) | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 4 | 0.50 | scal (6.3%) |
MOV $0x22,%EDX | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.25 | N/A |
CALL fa67e0 <@plt_start@+0x3330> | 2 | 0.50 | 0 | 0 | 0 | 0.50 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | N/A |
MOV -0x2c(%RBP),%EAX | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 0.33 | N/A |
CMP %EBX,%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%) |
CMOVL %EAX,%EBX | 1 | 0.50 | 0 | 0 | 0.50 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | scal (6.3%) |
MOV %EBX,-0x2c(%RBP) | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 4 | 0.50 | scal (6.3%) |
MOVSXD -0x30(%RBP),%RAX | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.33 | N/A |
CMP %EBX,%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%) |
JLE be5df5 <.omp_outlined.+0xb5> | 1 | 0.50 | 0 | 0 | 0 | 0.50 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50-1 | N/A |
LEA 0x3f8875(%RIP),%RDI | 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 -0x34(%RBP),%ESI | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 0.33 | scal (6.3%) |
CALL fa67f0 <@plt_start@+0x3340> | 2 | 0.50 | 0 | 0 | 0 | 0.50 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | N/A |
ADD $0x168,%RSP | 1 | 0.25 | 0.25 | 0.25 | 0.25 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.25 | N/A |
POP %RBX | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.33 | N/A |
POP %R12 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.33 | N/A |
POP %R13 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.33 | N/A |
POP %R14 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.33 | N/A |
POP %R15 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.33 | N/A |
POP %RBP | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.33 | N/A |
RET | 1 | 0.50 | 0 | 0 | 0 | 0.50 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | N/A |
MOV %RAX,%RBX | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.17 | scal (12.5%) |
MOV 0x10(%RBP),%R14 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 0.33 | scal (12.5%) |
JMP be5e10 <.omp_outlined.+0xd0> | 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 | 0.33 | 0 | 0.2 | 0 | 0.04 | 0.01 | 0.05 | 0.01 | 0.06 | 0 | 0.05 | 0 | 0.02 | 0.01 | 0.02 | 0.01 |
Run | Number of threads | Efficiency (ideal is 1) | Speedup | Ideal Speedup | Time (s) | Coverage (%) |
---|---|---|---|---|---|---|
1x1 | 1 | 1 | 1 | 1 | 0.00499999942258 | 0.00059980468358845 |
2x1 | 1 | 0.33 | 0.67 | 2 | 0.014999998733401 | 0.0016545951366425 |
4x1 | 3 | 0.2 | 0.8 | 4 | 0.014999996870756 | 0.0025103650987148 |
8x1 | 8 | 0.04 | 0.33 | 8 | 0.025000002235174 | 0.0096983695402741 |
16x1 | 11 | 0.05 | 0.72 | 16 | 0.01999999769032 | 0.0083497976884246 |
32x1 | 11 | 0.06 | 1.88 | 32 | 0.014999999664724 | 0.0051745045930147 |
64x1 | 17 | 0.05 | 2.9 | 64 | 0.014999999664724 | 0.0043393196538091 |
128x1 | 34 | 0.02 | 3.08 | 128 | 0.015000000596046 | 0.0095593063160777 |
192x1 | 44 | 0.02 | 3.28 | 192 | 0.015000000596046 | 0.011327303946018 |
Name | Coverage (%) | Time (s) |
---|---|---|
▼.omp_outlined.#0xbe5d40– | 0.01 | 0.00 |
▼Loop 1417 - listed_forces.cpp:388-451 - libgromacs_mpi.so.9.0.0– | 0.00 | 0.01 |
○Loop 1418 - utilities.h:56-57 - libgromacs_mpi.so.9.0.0 | 0.01 | 0.01 |