Function: std::enable_if<(((BondedKernelFlavor)2)!=((BondedKernelFlavor)0))||(!(1)), float>::type (a ... | Module: libgromacs_mpi.so.9.0.0 | Source: bonded.cpp:1913-2014 [...] | Coverage (incl. loops): 0.04% | (excl. loops): 0.00% |
---|
Function: std::enable_if<(((BondedKernelFlavor)2)!=((BondedKernelFlavor)0))||(!(1)), float>::type (a ... | Module: libgromacs_mpi.so.9.0.0 | Source: bonded.cpp:1913-2014 [...] | Coverage (incl. loops): 0.04% | (excl. loops): 0.00% |
---|
/usr/lib/gcc/x86_64-redhat-linux/11/../../../../include/c++/11/cmath: 185 - 426 |
-------------------------------------------------------------------------------- |
185: { return __builtin_cosf(__x); } |
[...] |
426: { return __builtin_sinf(__x); } |
/home/eoseret/gromacs-2024.2/src/gromacs/listed_forces/bonded.cpp: 1913 - 2014 |
-------------------------------------------------------------------------------- |
1913: const real ph0 = (L1 * phiA + lambda * phiB) * gmx::c_deg2Rad; |
1914: const real dph0 = (phiB - phiA) * gmx::c_deg2Rad; |
1915: const real cp = L1 * cpA + lambda * cpB; |
1916: |
1917: const real mdphi = mult * phi - ph0; |
1918: const real sdphi = std::sin(mdphi); |
1919: const real ddphi = -cp * mult * sdphi; |
1920: if (computeEnergy(flavor)) |
1921: { |
1922: const real v1 = 1 + std::cos(mdphi); |
1923: *V += cp * v1; |
1924: |
1925: *dvdlambda += (cpB - cpA) * v1 + cp * dph0 * sdphi; |
[...] |
1973: { |
[...] |
1979: for (int i = 0; i < nbonds;) |
1980: { |
1981: const int ai = forceatoms[i + 1]; |
1982: const int aj = forceatoms[i + 2]; |
1983: const int ak = forceatoms[i + 3]; |
1984: const int al = forceatoms[i + 4]; |
1985: |
1986: const real phi = |
1987: dih_angle(x[ai], x[aj], x[ak], x[al], pbc, r_ij, r_kj, r_kl, m, n, &t1, &t2, &t3); /* 84 */ |
[...] |
1993: do |
1994: { |
1995: const int type = forceatoms[i]; |
1996: ddphi_tot += dopdihs<flavor>(forceparams[type].pdihs.cpA, |
1997: forceparams[type].pdihs.cpB, |
1998: forceparams[type].pdihs.phiA, |
1999: forceparams[type].pdihs.phiB, |
[...] |
2007: } while (i < nbonds && forceatoms[i + 1] == ai && forceatoms[i + 2] == aj |
2008: && forceatoms[i + 3] == ak && forceatoms[i + 4] == al); |
2009: |
2010: do_dih_fup<flavor>( |
2011: ai, aj, ak, al, ddphi_tot, r_ij, r_kj, r_kl, m, n, f, fshift, pbc, x, t1, t2, t3); /* 112 */ |
2012: } /* 223 TOTAL */ |
2013: |
2014: return vtot; |
0xbd55a0 PUSH %RBP |
0xbd55a1 MOV %RSP,%RBP |
0xbd55a4 PUSH %R15 |
0xbd55a6 PUSH %R14 |
0xbd55a8 PUSH %R13 |
0xbd55aa PUSH %R12 |
0xbd55ac PUSH %RBX |
0xbd55ad SUB $0xb8,%RSP |
0xbd55b4 MOV %R9,-0x98(%RBP) |
0xbd55bb MOV %R8,-0x90(%RBP) |
0xbd55c2 TEST %EDI,%EDI |
0xbd55c4 JLE bd589c |
0xbd55ca MOV %RDX,%R12 |
0xbd55cd MOV %RSI,%R13 |
0xbd55d0 VMOVSS -0x87944c(%RIP),%XMM1 |
0xbd55d8 VMOVSS %XMM0,-0x40(%RBP) |
0xbd55dd VSUBSS %XMM0,%XMM1,%XMM0 |
0xbd55e1 VMOVSS %XMM0,-0x3c(%RBP) |
0xbd55e6 MOV %EDI,%EAX |
0xbd55e8 MOV %RAX,-0xa0(%RBP) |
0xbd55ef VXORPS %XMM0,%XMM0,%XMM0 |
0xbd55f3 VMOVSS %XMM0,-0x2c(%RBP) |
0xbd55f8 XOR %R15D,%R15D |
0xbd55fb LEA -0xb8(%RBP),%R10 |
0xbd5602 LEA -0xc4(%RBP),%R11 |
0xbd5609 LEA -0xac(%RBP),%R9 |
0xbd5610 MOV %RCX,-0x70(%RBP) |
0xbd5614 MOV %EDI,-0x38(%RBP) |
0xbd5617 JMP bd56a8 |
0xbd561c NOPL (%RAX) |
(16908) 0xbd5620 MOV -0x68(%RBP),%EAX |
(16908) 0xbd5623 MOV -0x64(%RBP),%R10D |
(16908) 0xbd5627 MOV -0x60(%RBP),%R11D |
(16908) 0xbd562b MOV %R14D,%EDI |
(16908) 0xbd562e MOV -0x88(%RBP),%RSI |
(16908) 0xbd5635 MOV -0x80(%RBP),%RDX |
(16908) 0xbd5639 MOV -0x78(%RBP),%RCX |
(16908) 0xbd563d VMOVSS -0x30(%RBP),%XMM0 |
(16908) 0xbd5642 LEA -0xac(%RBP),%R8 |
(16908) 0xbd5649 LEA -0xdc(%RBP),%R9 |
(16908) 0xbd5650 PUSH %R11 |
(16908) 0xbd5652 PUSH %R10 |
(16908) 0xbd5654 PUSH %RAX |
(16908) 0xbd5655 PUSHQ -0x70(%RBP) |
(16908) 0xbd5658 MOV 0x10(%RBP),%RAX |
(16908) 0xbd565c PUSH %RAX |
(16908) 0xbd565d PUSHQ -0x98(%RBP) |
(16908) 0xbd5663 PUSHQ -0x90(%RBP) |
(16908) 0xbd5669 LEA -0xb8(%RBP),%RBX |
(16908) 0xbd5670 PUSH %RBX |
(16908) 0xbd5671 LEA -0xc4(%RBP),%R14 |
(16908) 0xbd5678 PUSH %R14 |
(16908) 0xbd567a LEA -0xd0(%RBP),%RAX |
(16908) 0xbd5681 PUSH %RAX |
(16908) 0xbd5682 CALL fb4fe0 <@plt_start@+0x11b30> |
(16908) 0xbd5687 LEA -0xac(%RBP),%R9 |
(16908) 0xbd568e MOV %R14,%R11 |
(16908) 0xbd5691 MOV %RBX,%R10 |
(16908) 0xbd5694 MOV -0x70(%RBP),%RCX |
(16908) 0xbd5698 ADD $0x50,%RSP |
(16908) 0xbd569c MOV -0x38(%RBP),%EDI |
(16908) 0xbd569f CMP %EDI,%R15D |
(16908) 0xbd56a2 JGE bd58a5 |
(16908) 0xbd56a8 MOVSXD %R15D,%RBX |
(16908) 0xbd56ab MOVSXD 0x4(%R13,%RBX,4),%R14 |
(16908) 0xbd56b0 MOVSXD 0x8(%R13,%RBX,4),%RDX |
(16908) 0xbd56b5 MOVSXD 0xc(%R13,%RBX,4),%R15 |
(16908) 0xbd56ba MOVSXD 0x10(%R13,%RBX,4),%R8 |
(16908) 0xbd56bf LEA (%R14,%R14,2),%RAX |
(16908) 0xbd56c3 LEA (%RCX,%RAX,4),%RDI |
(16908) 0xbd56c7 MOV %RDX,-0x88(%RBP) |
(16908) 0xbd56ce LEA (%RDX,%RDX,2),%RAX |
(16908) 0xbd56d2 LEA (%RCX,%RAX,4),%RSI |
(16908) 0xbd56d6 MOV %R15,-0x80(%RBP) |
(16908) 0xbd56da LEA (%R15,%R15,2),%RAX |
(16908) 0xbd56de LEA (%RCX,%RAX,4),%RDX |
(16908) 0xbd56e2 MOV %R8,-0x78(%RBP) |
(16908) 0xbd56e6 LEA (%R8,%R8,2),%RAX |
(16908) 0xbd56ea LEA (%RCX,%RAX,4),%RCX |
(16908) 0xbd56ee SUB $0x8,%RSP |
(16908) 0xbd56f2 MOV 0x10(%RBP),%R8 |
(16908) 0xbd56f6 LEA -0x60(%RBP),%RAX |
(16908) 0xbd56fa PUSH %RAX |
(16908) 0xbd56fb LEA -0x64(%RBP),%RAX |
(16908) 0xbd56ff PUSH %RAX |
(16908) 0xbd5700 LEA -0x68(%RBP),%RAX |
(16908) 0xbd5704 PUSH %RAX |
(16908) 0xbd5705 PUSH %R10 |
(16908) 0xbd5707 PUSH %R11 |
(16908) 0xbd5709 LEA -0xd0(%RBP),%RAX |
(16908) 0xbd5710 PUSH %RAX |
(16908) 0xbd5711 LEA -0xdc(%RBP),%RAX |
(16908) 0xbd5718 PUSH %RAX |
(16908) 0xbd5719 CALL fac7b0 <@plt_start@+0x9300> |
(16908) 0xbd571e ADD $0x40,%RSP |
(16908) 0xbd5722 VMOVSS %XMM0,-0x44(%RBP) |
(16908) 0xbd5727 ADD $0x5,%RBX |
(16908) 0xbd572b VXORPS %XMM0,%XMM0,%XMM0 |
(16908) 0xbd572f VMOVSS %XMM0,-0x30(%RBP) |
(16908) 0xbd5734 NOPW %CS:(%RAX,%RAX,1) |
(16909) 0xbd5740 MOV %RBX,%R15 |
(16909) 0xbd5743 MOVSXD -0x14(%R13,%RBX,4),%RAX |
(16909) 0xbd5748 LEA (%RAX,%RAX,2),%RAX |
(16909) 0xbd574c SAL $0x4,%RAX |
(16909) 0xbd5750 VMOVSS (%R12,%RAX,1),%XMM0 |
(16909) 0xbd5756 VMOVSS 0x4(%R12,%RAX,1),%XMM6 |
(16909) 0xbd575d VMOVSS %XMM6,-0x54(%RBP) |
(16909) 0xbd5762 VMOVSS 0x10(%R12,%RAX,1),%XMM7 |
(16909) 0xbd5769 VMOVSS %XMM7,-0x58(%RBP) |
(16909) 0xbd576e VMOVSS 0xc(%R12,%RAX,1),%XMM1 |
(16909) 0xbd5775 VMOVSS -0x40(%RBP),%XMM3 |
(16909) 0xbd577a VMULSS %XMM3,%XMM1,%XMM2 |
(16909) 0xbd577e VMOVSS -0x3c(%RBP),%XMM4 |
(16909) 0xbd5783 VFMADD231SS %XMM0,%XMM4,%XMM2 |
(16909) 0xbd5788 VCVTSS2SD %XMM2,%XMM2,%XMM2 |
(16909) 0xbd578c VMOVSD -0x877fac(%RIP),%XMM5 |
(16909) 0xbd5794 VMULSD %XMM5,%XMM2,%XMM2 |
(16909) 0xbd5798 VCVTSD2SS %XMM2,%XMM2,%XMM2 |
(16909) 0xbd579c VSUBSS %XMM0,%XMM1,%XMM0 |
(16909) 0xbd57a0 VCVTSS2SD %XMM0,%XMM0,%XMM0 |
(16909) 0xbd57a4 VMULSD %XMM5,%XMM0,%XMM0 |
(16909) 0xbd57a8 VCVTSD2SS %XMM0,%XMM0,%XMM0 |
(16909) 0xbd57ac VMOVSS %XMM0,-0x5c(%RBP) |
(16909) 0xbd57b1 VMULSS %XMM3,%XMM7,%XMM0 |
(16909) 0xbd57b5 VFMADD231SS %XMM6,%XMM4,%XMM0 |
(16909) 0xbd57ba VMOVSS %XMM0,-0x34(%RBP) |
(16909) 0xbd57bf VCVTSI2SSL 0x8(%R12,%RAX,1),%XMM8,%XMM1 |
(16909) 0xbd57c6 VMOVSS %XMM1,-0x48(%RBP) |
(16909) 0xbd57cb VMOVAPS %XMM2,%XMM0 |
(16909) 0xbd57cf VFMSUB231SS -0x44(%RBP),%XMM1,%XMM0 |
(16909) 0xbd57d5 VMOVSS %XMM0,-0x4c(%RBP) |
(16909) 0xbd57da CALL fac760 <@plt_start@+0x92b0> |
(16909) 0xbd57df VMOVSS %XMM0,-0x50(%RBP) |
(16909) 0xbd57e4 VMOVSS -0x48(%RBP),%XMM1 |
(16909) 0xbd57e9 VMULSS -0x34(%RBP),%XMM1,%XMM1 |
(16909) 0xbd57ee VMULSS %XMM1,%XMM0,%XMM2 |
(16909) 0xbd57f2 VMOVSS -0x30(%RBP),%XMM1 |
(16909) 0xbd57f7 VSUBSS %XMM2,%XMM1,%XMM1 |
(16909) 0xbd57fb VMOVSS %XMM1,-0x30(%RBP) |
(16909) 0xbd5800 VMOVSS -0x4c(%RBP),%XMM0 |
(16909) 0xbd5805 CALL fac750 <@plt_start@+0x92a0> |
(16909) 0xbd580a VADDSS -0x879686(%RIP),%XMM0,%XMM0 |
(16909) 0xbd5812 VMOVSS -0x2c(%RBP),%XMM1 |
(16909) 0xbd5817 VMOVSS -0x34(%RBP),%XMM2 |
(16909) 0xbd581c VFMADD231SS %XMM0,%XMM2,%XMM1 |
(16909) 0xbd5821 VMOVSS %XMM1,-0x2c(%RBP) |
(16909) 0xbd5826 VMOVSS -0x58(%RBP),%XMM1 |
(16909) 0xbd582b VSUBSS -0x54(%RBP),%XMM1,%XMM1 |
(16909) 0xbd5830 VMULSS -0x5c(%RBP),%XMM2,%XMM2 |
(16909) 0xbd5835 VMULSS -0x50(%RBP),%XMM2,%XMM2 |
(16909) 0xbd583a VFMADD231SS %XMM1,%XMM0,%XMM2 |
(16909) 0xbd583f MOV 0x18(%RBP),%RAX |
(16909) 0xbd5843 VADDSS (%RAX),%XMM2,%XMM0 |
(16909) 0xbd5847 VMOVSS %XMM0,(%RAX) |
(16909) 0xbd584b CMP -0xa0(%RBP),%RBX |
(16909) 0xbd5852 JGE bd5620 |
(16909) 0xbd5858 CMP %R14D,0x4(%R13,%R15,4) |
(16909) 0xbd585d JNE bd5620 |
(16909) 0xbd5863 MOV -0x88(%RBP),%RAX |
(16909) 0xbd586a CMP %EAX,0x8(%R13,%R15,4) |
(16909) 0xbd586f JNE bd5620 |
(16909) 0xbd5875 MOV -0x80(%RBP),%RAX |
(16909) 0xbd5879 CMP %EAX,0xc(%R13,%R15,4) |
(16909) 0xbd587e JNE bd5620 |
(16909) 0xbd5884 LEA 0x5(%R15),%RBX |
(16909) 0xbd5888 MOV -0x78(%RBP),%RAX |
(16909) 0xbd588c CMP %EAX,0x10(%R13,%R15,4) |
(16909) 0xbd5891 JE bd5740 |
(16908) 0xbd5897 JMP bd5620 |
0xbd589c VXORPS %XMM0,%XMM0,%XMM0 |
0xbd58a0 VMOVSS %XMM0,-0x2c(%RBP) |
0xbd58a5 VMOVSS -0x2c(%RBP),%XMM0 |
0xbd58aa ADD $0xb8,%RSP |
0xbd58b1 POP %RBX |
0xbd58b2 POP %R12 |
0xbd58b4 POP %R13 |
0xbd58b6 POP %R14 |
0xbd58b8 POP %R15 |
0xbd58ba POP %RBP |
0xbd58bb RET |
0xbd58bc NOPL (%RAX) |
Coverage (%) | Name | Source Location | Module |
---|---|---|---|
►100.00+ | calculateSimpleBond(int, int, [...] | bonded.cpp:4143 | libgromacs_mpi.so.9.0.0 |
○ | (anonymous namespace)::calc_on[...] | listed_forces.cpp:356 | libgromacs_mpi.so.9.0.0 |
○ | .omp_outlined.#0xbe5d40 | listed_forces.cpp:428 | libgromacs_mpi.so.9.0.0 |
○ | __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 |
---|---|---|---|
►100.00+ | calculateSimpleBond(int, int, [...] | bonded.cpp:4143 | libgromacs_mpi.so.9.0.0 |
○ | (anonymous namespace)::calc_on[...] | listed_forces.cpp:356 | libgromacs_mpi.so.9.0.0 |
○ | .omp_outlined.#0xbe5d40 | listed_forces.cpp:428 | libgromacs_mpi.so.9.0.0 |
○ | __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 |
---|---|---|---|
►100.00+ | calculateSimpleBond(int, int, [...] | bonded.cpp:4143 | libgromacs_mpi.so.9.0.0 |
○ | (anonymous namespace)::calc_on[...] | listed_forces.cpp:356 | libgromacs_mpi.so.9.0.0 |
○ | .omp_outlined.#0xbe5d40 | listed_forces.cpp:428 | libgromacs_mpi.so.9.0.0 |
○ | __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 |
---|---|---|---|
►58.68+ | calculateSimpleBond(int, int, [...] | bonded.cpp:4143 | libgromacs_mpi.so.9.0.0 |
○ | (anonymous namespace)::calc_on[...] | listed_forces.cpp:356 | libgromacs_mpi.so.9.0.0 |
○ | .omp_outlined.#0xbe5d40 | listed_forces.cpp:428 | libgromacs_mpi.so.9.0.0 |
○ | __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 | |
►24.55+ | calculateSimpleBond(int, int, [...] | bonded.cpp:4143 | libgromacs_mpi.so.9.0.0 |
○ | (anonymous namespace)::calc_on[...] | listed_forces.cpp:356 | libgromacs_mpi.so.9.0.0 |
○ | .omp_outlined.#0xbe5d40 | listed_forces.cpp:428 | libgromacs_mpi.so.9.0.0 |
○ | __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 |
►16.77+ | calculateSimpleBond(int, int, [...] | bonded.cpp:4143 | libgromacs_mpi.so.9.0.0 |
○ | (anonymous namespace)::calc_on[...] | listed_forces.cpp:356 | libgromacs_mpi.so.9.0.0 |
○ | .omp_outlined.#0xbe5d40 | listed_forces.cpp:428 | libgromacs_mpi.so.9.0.0 |
○ | __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 |
---|---|---|---|
►69.44+ | calculateSimpleBond(int, int, [...] | bonded.cpp:4143 | libgromacs_mpi.so.9.0.0 |
○ | (anonymous namespace)::calc_on[...] | listed_forces.cpp:356 | libgromacs_mpi.so.9.0.0 |
○ | .omp_outlined.#0xbe5d40 | listed_forces.cpp:428 | libgromacs_mpi.so.9.0.0 |
○ | __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 | |
►25.69+ | calculateSimpleBond(int, int, [...] | bonded.cpp:4143 | libgromacs_mpi.so.9.0.0 |
○ | (anonymous namespace)::calc_on[...] | listed_forces.cpp:356 | libgromacs_mpi.so.9.0.0 |
○ | .omp_outlined.#0xbe5d40 | listed_forces.cpp:428 | libgromacs_mpi.so.9.0.0 |
○ | __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 |
►4.86+ | calculateSimpleBond(int, int, [...] | bonded.cpp:4143 | libgromacs_mpi.so.9.0.0 |
○ | (anonymous namespace)::calc_on[...] | listed_forces.cpp:356 | libgromacs_mpi.so.9.0.0 |
○ | .omp_outlined.#0xbe5d40 | listed_forces.cpp:428 | libgromacs_mpi.so.9.0.0 |
○ | __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 |
---|---|---|---|
►81.43+ | calculateSimpleBond(int, int, [...] | bonded.cpp:4143 | libgromacs_mpi.so.9.0.0 |
○ | (anonymous namespace)::calc_on[...] | listed_forces.cpp:356 | libgromacs_mpi.so.9.0.0 |
○ | .omp_outlined.#0xbe5d40 | listed_forces.cpp:428 | libgromacs_mpi.so.9.0.0 |
○ | __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 | |
►18.57+ | calculateSimpleBond(int, int, [...] | bonded.cpp:4143 | libgromacs_mpi.so.9.0.0 |
○ | (anonymous namespace)::calc_on[...] | listed_forces.cpp:356 | libgromacs_mpi.so.9.0.0 |
○ | .omp_outlined.#0xbe5d40 | listed_forces.cpp:428 | libgromacs_mpi.so.9.0.0 |
○ | __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 |
---|---|---|---|
►95.06+ | calculateSimpleBond(int, int, [...] | bonded.cpp:4143 | libgromacs_mpi.so.9.0.0 |
○ | (anonymous namespace)::calc_on[...] | listed_forces.cpp:356 | libgromacs_mpi.so.9.0.0 |
○ | .omp_outlined.#0xbe5d40 | listed_forces.cpp:428 | libgromacs_mpi.so.9.0.0 |
○ | __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 | |
►4.94+ | calculateSimpleBond(int, int, [...] | bonded.cpp:4143 | libgromacs_mpi.so.9.0.0 |
○ | (anonymous namespace)::calc_on[...] | listed_forces.cpp:356 | libgromacs_mpi.so.9.0.0 |
○ | .omp_outlined.#0xbe5d40 | listed_forces.cpp:428 | libgromacs_mpi.so.9.0.0 |
○ | __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 |
---|---|---|---|
►79.31+ | calculateSimpleBond(int, int, [...] | bonded.cpp:4143 | libgromacs_mpi.so.9.0.0 |
○ | (anonymous namespace)::calc_on[...] | listed_forces.cpp:356 | libgromacs_mpi.so.9.0.0 |
○ | .omp_outlined.#0xbe5d40 | listed_forces.cpp:428 | libgromacs_mpi.so.9.0.0 |
○ | __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 | |
►11.49+ | calculateSimpleBond(int, int, [...] | bonded.cpp:4143 | libgromacs_mpi.so.9.0.0 |
○ | (anonymous namespace)::calc_on[...] | listed_forces.cpp:356 | libgromacs_mpi.so.9.0.0 |
○ | .omp_outlined.#0xbe5d40 | listed_forces.cpp:428 | libgromacs_mpi.so.9.0.0 |
○ | __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 |
►8.62+ | calculateSimpleBond(int, int, [...] | bonded.cpp:4143 | libgromacs_mpi.so.9.0.0 |
○ | (anonymous namespace)::calc_on[...] | listed_forces.cpp:356 | libgromacs_mpi.so.9.0.0 |
○ | .omp_outlined.#0xbe5d40 | listed_forces.cpp:428 | libgromacs_mpi.so.9.0.0 |
○ | __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 |
---|---|---|---|
►98.40+ | calculateSimpleBond(int, int, [...] | bonded.cpp:4143 | libgromacs_mpi.so.9.0.0 |
○ | (anonymous namespace)::calc_on[...] | listed_forces.cpp:356 | libgromacs_mpi.so.9.0.0 |
○ | .omp_outlined.#0xbe5d40 | listed_forces.cpp:428 | libgromacs_mpi.so.9.0.0 |
○ | __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 | |
►1.60+ | (anonymous namespace)::calc_on[...] | listed_forces.cpp:356 | libgromacs_mpi.so.9.0.0 |
○ | .omp_outlined.#0xbe5d40 | listed_forces.cpp:428 | libgromacs_mpi.so.9.0.0 |
○ | __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 |
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 | bonded.cpp:1913-2014 |
Module | libgromacs_mpi.so.9.0.0 |
nb instructions | 42 |
nb uops | 40 |
loop length | 164 |
used x86 registers | 16 |
used mmx registers | 0 |
used xmm registers | 2 |
used ymm registers | 0 |
used zmm registers | 0 |
nb stack references | 11 |
micro-operation queue | 6.67 cycles |
front end | 6.67 cycles |
ALU0/BRU0 | ALU1 | ALU2 | ALU3 | BRU1 | AGU0 | AGU1 | AGU2 | FP0 | FP1 | FP2 | FP3 | FP4 | FP5 | |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
uops | 2.00 | 2.00 | 1.75 | 1.75 | 1.50 | 3.67 | 3.67 | 3.67 | 0.00 | 0.00 | 0.50 | 0.50 | 2.00 | 2.00 |
cycles | 2.00 | 2.00 | 1.75 | 1.75 | 1.50 | 3.67 | 3.67 | 3.67 | 0.00 | 0.00 | 0.50 | 0.50 | 2.00 | 2.00 |
Cycles executing div or sqrt instructions | NA |
Front-end | 6.67 |
Dispatch | 3.67 |
Overall L1 | 6.67 |
all | 0% |
load | NA (no load vectorizable/vectorized instructions) |
store | 0% |
mul | NA (no mul vectorizable/vectorized instructions) |
add-sub | NA (no add-sub vectorizable/vectorized instructions) |
fma | NA (no fma vectorizable/vectorized instructions) |
other | 0% |
all | 22% |
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 | 100% |
all | 11% |
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 | 33% |
all | 10% |
load | NA (no load vectorizable/vectorized instructions) |
store | 11% |
mul | NA (no mul vectorizable/vectorized instructions) |
add-sub | NA (no add-sub vectorizable/vectorized instructions) |
fma | NA (no fma vectorizable/vectorized instructions) |
other | 9% |
all | 10% |
load | 6% |
store | 6% |
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 | 25% |
all | 10% |
load | 6% |
store | 9% |
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 | 14% |
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 $0xb8,%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,-0x98(%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,-0x90(%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%) |
TEST %EDI,%EDI | 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 bd589c <_ZN12_GLOBAL__N_15pdihsIL18BondedKernelFlavor2EEENSt9enable_ifIXooneT_LS1_0EntLi1EEfE4typeEiPKiPK9t_iparamsPA3_KfPA4_fPA3_fPK5t_pbcfPfN3gmx8ArrayRefISA_EEP8t_fcdataP12t_disresdataP12t_oriresdataPi+0x2fc> | 1 | 0.50 | 0 | 0 | 0 | 0.50 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50-1 | N/A |
MOV %RDX,%R12 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.17 | scal (12.5%) |
MOV %RSI,%R13 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.17 | scal (12.5%) |
VMOVSS -0x87944c(%RIP),%XMM1 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | scal (6.3%) |
VMOVSS %XMM0,-0x40(%RBP) | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 1 | 1 | scal (6.3%) |
VSUBSS %XMM0,%XMM1,%XMM0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
VMOVSS %XMM0,-0x3c(%RBP) | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 1 | 1 | scal (6.3%) |
MOV %EDI,%EAX | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.17 | N/A |
MOV %RAX,-0xa0(%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%) |
VXORPS %XMM0,%XMM0,%XMM0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.17 | vect (25.0%) |
VMOVSS %XMM0,-0x2c(%RBP) | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 1 | 1 | scal (6.3%) |
XOR %R15D,%R15D | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.25 | scal (6.3%) |
LEA -0xb8(%RBP),%R10 | 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 -0xc4(%RBP),%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 -0xac(%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 %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 %EDI,-0x38(%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%) |
JMP bd56a8 <_ZN12_GLOBAL__N_15pdihsIL18BondedKernelFlavor2EEENSt9enable_ifIXooneT_LS1_0EntLi1EEfE4typeEiPKiPK9t_iparamsPA3_KfPA4_fPA3_fPK5t_pbcfPfN3gmx8ArrayRefISA_EEP8t_fcdataP12t_disresdataP12t_oriresdataPi+0x108> | 1 | 0.50 | 0 | 0 | 0 | 0.50 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | N/A |
NOPL (%RAX) | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.09 | N/A |
VXORPS %XMM0,%XMM0,%XMM0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.17 | vect (25.0%) |
VMOVSS %XMM0,-0x2c(%RBP) | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 1 | 1 | scal (6.3%) |
VMOVSS -0x2c(%RBP),%XMM0 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | scal (6.3%) |
ADD $0xb8,%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 |
NOPL (%RAX) | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.09 | 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 | bonded.cpp:1913-2014 |
Module | libgromacs_mpi.so.9.0.0 |
nb instructions | 42 |
nb uops | 40 |
loop length | 164 |
used x86 registers | 16 |
used mmx registers | 0 |
used xmm registers | 2 |
used ymm registers | 0 |
used zmm registers | 0 |
nb stack references | 11 |
micro-operation queue | 6.67 cycles |
front end | 6.67 cycles |
ALU0/BRU0 | ALU1 | ALU2 | ALU3 | BRU1 | AGU0 | AGU1 | AGU2 | FP0 | FP1 | FP2 | FP3 | FP4 | FP5 | |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
uops | 2.00 | 2.00 | 1.75 | 1.75 | 1.50 | 3.67 | 3.67 | 3.67 | 0.00 | 0.00 | 0.50 | 0.50 | 2.00 | 2.00 |
cycles | 2.00 | 2.00 | 1.75 | 1.75 | 1.50 | 3.67 | 3.67 | 3.67 | 0.00 | 0.00 | 0.50 | 0.50 | 2.00 | 2.00 |
Cycles executing div or sqrt instructions | NA |
Front-end | 6.67 |
Dispatch | 3.67 |
Overall L1 | 6.67 |
all | 0% |
load | NA (no load vectorizable/vectorized instructions) |
store | 0% |
mul | NA (no mul vectorizable/vectorized instructions) |
add-sub | NA (no add-sub vectorizable/vectorized instructions) |
fma | NA (no fma vectorizable/vectorized instructions) |
other | 0% |
all | 22% |
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 | 100% |
all | 11% |
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 | 33% |
all | 10% |
load | NA (no load vectorizable/vectorized instructions) |
store | 11% |
mul | NA (no mul vectorizable/vectorized instructions) |
add-sub | NA (no add-sub vectorizable/vectorized instructions) |
fma | NA (no fma vectorizable/vectorized instructions) |
other | 9% |
all | 10% |
load | 6% |
store | 6% |
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 | 25% |
all | 10% |
load | 6% |
store | 9% |
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 | 14% |
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 $0xb8,%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,-0x98(%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,-0x90(%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%) |
TEST %EDI,%EDI | 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 bd589c <_ZN12_GLOBAL__N_15pdihsIL18BondedKernelFlavor2EEENSt9enable_ifIXooneT_LS1_0EntLi1EEfE4typeEiPKiPK9t_iparamsPA3_KfPA4_fPA3_fPK5t_pbcfPfN3gmx8ArrayRefISA_EEP8t_fcdataP12t_disresdataP12t_oriresdataPi+0x2fc> | 1 | 0.50 | 0 | 0 | 0 | 0.50 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50-1 | N/A |
MOV %RDX,%R12 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.17 | scal (12.5%) |
MOV %RSI,%R13 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.17 | scal (12.5%) |
VMOVSS -0x87944c(%RIP),%XMM1 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | scal (6.3%) |
VMOVSS %XMM0,-0x40(%RBP) | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 1 | 1 | scal (6.3%) |
VSUBSS %XMM0,%XMM1,%XMM0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 0 | 0 | 3 | 0.50 | scal (6.3%) |
VMOVSS %XMM0,-0x3c(%RBP) | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 1 | 1 | scal (6.3%) |
MOV %EDI,%EAX | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.17 | N/A |
MOV %RAX,-0xa0(%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%) |
VXORPS %XMM0,%XMM0,%XMM0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.17 | vect (25.0%) |
VMOVSS %XMM0,-0x2c(%RBP) | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 1 | 1 | scal (6.3%) |
XOR %R15D,%R15D | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.25 | scal (6.3%) |
LEA -0xb8(%RBP),%R10 | 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 -0xc4(%RBP),%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 -0xac(%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 %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 %EDI,-0x38(%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%) |
JMP bd56a8 <_ZN12_GLOBAL__N_15pdihsIL18BondedKernelFlavor2EEENSt9enable_ifIXooneT_LS1_0EntLi1EEfE4typeEiPKiPK9t_iparamsPA3_KfPA4_fPA3_fPK5t_pbcfPfN3gmx8ArrayRefISA_EEP8t_fcdataP12t_disresdataP12t_oriresdataPi+0x108> | 1 | 0.50 | 0 | 0 | 0 | 0.50 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | N/A |
NOPL (%RAX) | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.09 | N/A |
VXORPS %XMM0,%XMM0,%XMM0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.17 | vect (25.0%) |
VMOVSS %XMM0,-0x2c(%RBP) | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0.50 | 0.50 | 1 | 1 | scal (6.3%) |
VMOVSS -0x2c(%RBP),%XMM0 | 1 | 0 | 0 | 0 | 0 | 0 | 0.33 | 0.33 | 0.33 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0.50 | scal (6.3%) |
ADD $0xb8,%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 |
NOPL (%RAX) | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0.09 | 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 | 0.93 | 0.01 | 1.08 | 0 | 0.93 | 0 | 1.07 | -0 | 1.11 | -0 | 0.95 | 0 | 0.88 | 0 | 0.82 | 0.01 |
Run | Number of threads | Efficiency (ideal is 1) | Speedup | Ideal Speedup | Time (s) | Coverage (%) |
---|---|---|---|---|---|---|
1x1 | 1 | 1 | 1 | 1 | 0.77499997615814 | 0.092969730496407 |
2x1 | 2 | 0.93 | 1.87 | 2 | 0.47999995946884 | 0.091556884348392 |
4x1 | 4 | 1.08 | 4.33 | 4 | 0.25999999046326 | 0.071791879832745 |
8x1 | 8 | 0.93 | 7.42 | 8 | 0.20499999821186 | 0.067484304308891 |
16x1 | 15 | 1.07 | 17.15 | 16 | 0.13000001013279 | 0.054653014987707 |
32x1 | 16 | 1.11 | 35.39 | 32 | 0.099999994039536 | 0.042613245546818 |
64x1 | 33 | 0.95 | 61.03 | 64 | 0.054999988526106 | 0.031952671706676 |
128x1 | 48 | 0.88 | 112.41 | 128 | 0.054999995976686 | 0.040567673742771 |
192x1 | 65 | 0.82 | 157.54 | 192 | 0.054999992251396 | 0.036520600318909 |
Name | Coverage (%) | Time (s) |
---|---|---|
▼std::enable_if<(((BondedKernelFlavor)2)!=((BondedKernelFlavor)0))||(!(1)), float>::type (anonymous namespace)::pdihs<(BondedKernelFlavor)2>(int, int const*, t_iparams const*, float const (*) [3], float (*) [4], float (*) [3], t_pbc const*, float, float*, g...– | 0.04 | 0.00 |
▼Loop 16908 - bonded.cpp:1913-2011 - libgromacs_mpi.so.9.0.0– | 0.01 | 0.01 |
○Loop 16909 - bonded.cpp:1913-2008 - libgromacs_mpi.so.9.0.0 | 0.03 | 0.01 |