nb_kernel130_ia32_sse.s
来自「最著名最快的分子模拟软件」· S 代码 · 共 1,988 行 · 第 1/4 页
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mulss %xmm3,%xmm2 ## xmm0-xmm2 contains tx-tz (partial force) ## now update f_i movaps nb130_fix(%esp),%xmm3 movaps nb130_fiy(%esp),%xmm4 movaps nb130_fiz(%esp),%xmm5 addss %xmm0,%xmm3 addss %xmm1,%xmm4 addss %xmm2,%xmm5 movaps %xmm3,nb130_fix(%esp) movaps %xmm4,nb130_fiy(%esp) movaps %xmm5,nb130_fiz(%esp) ## update fj movl nb130_faction(%ebp),%edi movss (%edi,%eax,4),%xmm3 movss 4(%edi,%eax,4),%xmm4 movss 8(%edi,%eax,4),%xmm5 subss %xmm0,%xmm3 subss %xmm1,%xmm4 subss %xmm2,%xmm5 movss %xmm3,(%edi,%eax,4) movss %xmm4,4(%edi,%eax,4) movss %xmm5,8(%edi,%eax,4)_nb_kernel130_ia32_sse.nb130_updateouterdata: movl nb130_ii3(%esp),%ecx movl nb130_faction(%ebp),%edi movl nb130_fshift(%ebp),%esi movl nb130_is3(%esp),%edx ## accumulate i forces in xmm0, xmm1, xmm2 movaps nb130_fix(%esp),%xmm0 movaps nb130_fiy(%esp),%xmm1 movaps nb130_fiz(%esp),%xmm2 movhlps %xmm0,%xmm3 movhlps %xmm1,%xmm4 movhlps %xmm2,%xmm5 addps %xmm3,%xmm0 addps %xmm4,%xmm1 addps %xmm5,%xmm2 ## sum is in 1/2 in xmm0-xmm2 movaps %xmm0,%xmm3 movaps %xmm1,%xmm4 movaps %xmm2,%xmm5 shufps $1,%xmm3,%xmm3 shufps $1,%xmm4,%xmm4 shufps $1,%xmm5,%xmm5 addss %xmm3,%xmm0 addss %xmm4,%xmm1 addss %xmm5,%xmm2 ## xmm0-xmm2 has single force in pos0 ## increment i force movss (%edi,%ecx,4),%xmm3 movss 4(%edi,%ecx,4),%xmm4 movss 8(%edi,%ecx,4),%xmm5 addss %xmm0,%xmm3 addss %xmm1,%xmm4 addss %xmm2,%xmm5 movss %xmm3,(%edi,%ecx,4) movss %xmm4,4(%edi,%ecx,4) movss %xmm5,8(%edi,%ecx,4) ## increment fshift force movss (%esi,%edx,4),%xmm3 movss 4(%esi,%edx,4),%xmm4 movss 8(%esi,%edx,4),%xmm5 addss %xmm0,%xmm3 addss %xmm1,%xmm4 addss %xmm2,%xmm5 movss %xmm3,(%esi,%edx,4) movss %xmm4,4(%esi,%edx,4) movss %xmm5,8(%esi,%edx,4) ## get n from stack movl nb130_n(%esp),%esi ## get group index for i particle movl nb130_gid(%ebp),%edx ## base of gid[] movl (%edx,%esi,4),%edx ## ggid=gid[n] ## accumulate total potential energy and update it movaps nb130_vctot(%esp),%xmm7 ## accumulate movhlps %xmm7,%xmm6 addps %xmm6,%xmm7 ## pos 0-1 in xmm7 have the sum now movaps %xmm7,%xmm6 shufps $1,%xmm6,%xmm6 addss %xmm6,%xmm7 ## add earlier value from mem movl nb130_Vc(%ebp),%eax addss (%eax,%edx,4),%xmm7 ## move back to mem movss %xmm7,(%eax,%edx,4) ## accumulate total lj energy and update it movaps nb130_Vvdwtot(%esp),%xmm7 ## accumulate movhlps %xmm7,%xmm6 addps %xmm6,%xmm7 ## pos 0-1 in xmm7 have the sum now movaps %xmm7,%xmm6 shufps $1,%xmm6,%xmm6 addss %xmm6,%xmm7 ## add earlier value from mem movl nb130_Vvdw(%ebp),%eax addss (%eax,%edx,4),%xmm7 ## move back to mem movss %xmm7,(%eax,%edx,4) ## finish if last movl nb130_nn1(%esp),%ecx ## esi already loaded with n incl %esi subl %esi,%ecx jz _nb_kernel130_ia32_sse.nb130_outerend ## not last, iterate outer loop once more! movl %esi,nb130_n(%esp) jmp _nb_kernel130_ia32_sse.nb130_outer_nb_kernel130_ia32_sse.nb130_outerend: ## check if more outer neighborlists remain movl nb130_nri(%esp),%ecx ## esi already loaded with n above subl %esi,%ecx jz _nb_kernel130_ia32_sse.nb130_end ## non-zero, do one more workunit jmp _nb_kernel130_ia32_sse.nb130_threadloop_nb_kernel130_ia32_sse.nb130_end: emms movl nb130_nouter(%esp),%eax movl nb130_ninner(%esp),%ebx movl nb130_outeriter(%ebp),%ecx movl nb130_inneriter(%ebp),%edx movl %eax,(%ecx) movl %ebx,(%edx) movl nb130_salign(%esp),%eax addl %eax,%esp addl $400,%esp popl %edi popl %esi popl %edx popl %ecx popl %ebx popl %eax leave ret.globl nb_kernel130nf_ia32_sse.globl _nb_kernel130nf_ia32_ssenb_kernel130nf_ia32_sse: _nb_kernel130nf_ia32_sse: .set nb130nf_p_nri, 8.set nb130nf_iinr, 12.set nb130nf_jindex, 16.set nb130nf_jjnr, 20.set nb130nf_shift, 24.set nb130nf_shiftvec, 28.set nb130nf_fshift, 32.set nb130nf_gid, 36.set nb130nf_pos, 40.set nb130nf_faction, 44.set nb130nf_charge, 48.set nb130nf_p_facel, 52.set nb130nf_argkrf, 56.set nb130nf_argcrf, 60.set nb130nf_Vc, 64.set nb130nf_type, 68.set nb130nf_p_ntype, 72.set nb130nf_vdwparam, 76.set nb130nf_Vvdw, 80.set nb130nf_p_tabscale, 84.set nb130nf_VFtab, 88.set nb130nf_invsqrta, 92.set nb130nf_dvda, 96.set nb130nf_p_gbtabscale, 100.set nb130nf_GBtab, 104.set nb130nf_p_nthreads, 108.set nb130nf_count, 112.set nb130nf_mtx, 116.set nb130nf_outeriter, 120.set nb130nf_inneriter, 124.set nb130nf_work, 128 ## stack offsets for local variables ## bottom of stack is cache-aligned for sse use .set nb130nf_ix, 0.set nb130nf_iy, 16.set nb130nf_iz, 32.set nb130nf_iq, 48.set nb130nf_dx, 64.set nb130nf_dy, 80.set nb130nf_dz, 96.set nb130nf_c6, 112.set nb130nf_c12, 128.set nb130nf_tsc, 144.set nb130nf_vctot, 160.set nb130nf_Vvdwtot, 176.set nb130nf_half, 192.set nb130nf_three, 208.set nb130nf_krf, 224.set nb130nf_crf, 240.set nb130nf_is3, 256.set nb130nf_ii3, 260.set nb130nf_ntia, 264.set nb130nf_innerjjnr, 268.set nb130nf_innerk, 272.set nb130nf_n, 276.set nb130nf_nn1, 280.set nb130nf_nri, 284.set nb130nf_facel, 288.set nb130nf_ntype, 292.set nb130nf_nouter, 296.set nb130nf_ninner, 300.set nb130nf_salign, 304 pushl %ebp movl %esp,%ebp pushl %eax pushl %ebx pushl %ecx pushl %edx pushl %esi pushl %edi subl $304,%esp ## local stack space movl %esp,%eax andl $0xf,%eax subl %eax,%esp movl %eax,nb130nf_salign(%esp) emms ## Move args passed by reference to stack movl nb130nf_p_nri(%ebp),%ecx movl nb130nf_p_facel(%ebp),%esi movl nb130nf_p_ntype(%ebp),%edi movl (%ecx),%ecx movl (%esi),%esi movl (%edi),%edi movl %ecx,nb130nf_nri(%esp) movl %esi,nb130nf_facel(%esp) movl %edi,nb130nf_ntype(%esp) ## zero iteration counters movl $0,%eax movl %eax,nb130nf_nouter(%esp) movl %eax,nb130nf_ninner(%esp) movl nb130nf_p_tabscale(%ebp),%eax movss (%eax),%xmm3 shufps $0,%xmm3,%xmm3 movaps %xmm3,nb130nf_tsc(%esp) ## create constant floating-point factors on stack movl $0x3f000000,%eax ## constant 0.5 in IEEE (hex) movl %eax,nb130nf_half(%esp) movss nb130nf_half(%esp),%xmm1 shufps $0,%xmm1,%xmm1 ## splat to all elements movaps %xmm1,%xmm2 addps %xmm2,%xmm2 ## constant 1.0 movaps %xmm2,%xmm3 addps %xmm2,%xmm2 ## constant 2.0 addps %xmm2,%xmm3 ## constant 3.0 movaps %xmm1,nb130nf_half(%esp) movaps %xmm3,nb130nf_three(%esp)_nb_kernel130nf_ia32_sse.nb130nf_threadloop: movl nb130nf_count(%ebp),%esi ## pointer to sync counter movl (%esi),%eax_nb_kernel130nf_ia32_sse.nb130nf_spinlock: movl %eax,%ebx ## ebx=*count=nn0 addl $1,%ebx ## ebx=nn1=nn0+10 lock cmpxchgl %ebx,(%esi) ## write nn1 to *counter, ## if it hasnt changed. ## or reread *counter to eax. pause ## -> better p4 performance jnz _nb_kernel130nf_ia32_sse.nb130nf_spinlock ## if(nn1>nri) nn1=nri movl nb130nf_nri(%esp),%ecx movl %ecx,%edx subl %ebx,%ecx cmovlel %edx,%ebx ## if(nn1>nri) nn1=nri ## Cleared the spinlock if we got here. ## eax contains nn0, ebx contains nn1. movl %eax,nb130nf_n(%esp) movl %ebx,nb130nf_nn1(%esp) subl %eax,%ebx ## calc number of outer lists movl %eax,%esi ## copy n to esi jg _nb_kernel130nf_ia32_sse.nb130nf_outerstart jmp _nb_kernel130nf_ia32_sse.nb130nf_end_nb_kernel130nf_ia32_sse.nb130nf_outerstart: ## ebx contains number of outer iterations addl nb130nf_nouter(%esp),%ebx movl %ebx,nb130nf_nouter(%esp)_nb_kernel130nf_ia32_sse.nb130nf_outer: movl nb130nf_shift(%ebp),%eax ## eax = pointer into shift[] movl (%eax,%esi,4),%ebx ## ebx=shift[n] leal (%ebx,%ebx,2),%ebx ## ebx=3*is movl %ebx,nb130nf_is3(%esp) ## store is3 movl nb130nf_shiftvec(%ebp),%eax ## eax = base of shiftvec[] movss (%eax,%ebx,4),%xmm0 movss 4(%eax,%ebx,4),%xmm1 movss 8(%eax,%ebx,4),%xmm2 movl nb130nf_iinr(%ebp),%ecx ## ecx = pointer into iinr[] movl (%ecx,%esi,4),%ebx ## ebx =ii movl nb130nf_charge(%ebp),%edx movss (%edx,%ebx,4),%xmm3 mulss nb130nf_facel(%esp),%xmm3 shufps $0,%xmm3,%xmm3 movl nb130nf_type(%ebp),%edx movl (%edx,%ebx,4),%edx imull nb130nf_ntype(%esp),%edx shll %edx movl %edx,nb130nf_ntia(%esp) leal (%ebx,%ebx,2),%ebx ## ebx = 3*ii=ii3 movl nb130nf_pos(%ebp),%eax ## eax = base of pos[] addss (%eax,%ebx,4),%xmm0 addss 4(%eax,%ebx,4),%xmm1 addss 8(%eax,%ebx,4),%xmm2 movaps %xmm3,nb130nf_iq(%esp) shufps $0,%xmm0,%xmm0 shufps $0,%xmm1,%xmm1 shufps $0,%xmm2,%xmm2 movaps %xmm0,nb130nf_ix(%esp) movaps %xmm1,nb130nf_iy(%esp) movaps %xmm2,nb130nf_iz(%esp) movl %ebx,nb130nf_ii3(%esp) ## clear vctot and i forces xorps %xmm4,%xmm4 movaps %xmm4,nb130nf_vctot(%esp) movaps %xmm4,nb130nf_Vvdwtot(%esp) movl nb130nf_jindex(%ebp),%eax movl (%eax,%esi,4),%ecx ## jindex[n] movl 4(%eax,%esi,4),%edx ## jindex[n+1] subl %ecx,%edx ## number of innerloop atoms movl nb130nf_pos(%ebp),%esi movl nb130nf_jjnr(%ebp),%eax shll $2,%ecx addl %ecx,%eax movl %eax,nb130nf_innerjjnr(%esp) ## pointer to jjnr[nj0] movl %edx,%ecx subl $4,%edx addl nb130nf_ninner(%esp),%ecx movl %ecx,nb130nf_ninner(%esp) addl $0,%edx movl %edx,nb130nf_innerk(%esp) ## number of innerloop atoms jge _nb_kernel130nf_ia32_sse.nb130nf_unroll_loop jmp _nb_kernel130nf_ia32_sse.nb130nf_finish_inner_nb_kernel130nf_ia32_sse.nb130nf_unroll_loop: ## quad-unroll innerloop here movl nb130nf_innerjjnr(%esp),%edx ## pointer to jjnr[k] movl (%edx),%eax movl 4(%edx),%ebx movl 8(%edx),%ecx movl 12(%edx),%edx ## eax-edx=jnr1-4 addl $16,nb130nf_innerjjnr(%esp) ## advance pointer (unrolled 4) movl nb130nf_charge(%ebp),%esi ## base of charge[] movss (%esi,%eax,4),%xmm3 movss (%esi,%ecx,4),%xmm4 movss (%esi,%ebx,4),%xmm6 movss (%esi,%edx,4),%xmm7 movaps nb130nf_iq(%esp),%xmm2 shufps $0,%xmm6,%xmm3 shufps $0,%xmm7,%xmm4 shufps $136,%xmm4,%xmm3 ## constant 10001000 ;# all charges in xmm3 movd %eax,%mm0 ## use mmx registers as temp storage movd %ebx,%mm1 movd %ecx,%mm2 movd %edx,%mm3 movl nb130nf_type(%ebp),%esi movl (%esi,%eax,4),%eax movl (%esi,%ebx,4),%ebx movl (%esi,%ecx,4),%ecx movl (%esi,%edx,4),%edx movl nb130nf_vdwparam(%ebp),%esi shll %eax shll %ebx shll %ecx shll %edx movl nb130nf_ntia(%esp),%edi addl %edi,%eax addl %edi,%ebx addl %edi,%ecx addl %edi,%edx movlps (%esi,%eax,4),%xmm6 movlps (%esi,%ecx,4),%xmm7 movhps (%esi,%ebx,4),%xmm6 movhps (%esi,%edx,4),%xmm7 movaps %xmm6,%xmm4 shufps $136,%xmm7,%xmm4 ## constant 10001000 shufps $221,%xmm7,%xmm6 ## constant 11011101 movd %mm0,%eax movd %mm1,%ebx movd %mm2,%ecx movd %mm3,%edx movaps %xmm4,nb130nf_c6(%esp) movaps %xmm6,nb130nf_c12(%esp) movl nb130nf_pos(%ebp),%esi ## base of pos[] leal (%eax,%eax,2),%eax ## replace jnr with j3 leal (%ebx,%ebx,2),%ebx mulps %xmm2,%xmm3 leal (%ecx,%ecx,2),%ecx ## replace jnr with j3 leal (%edx,%edx,2),%edx ## move four coordinates to xmm0-xmm2 movlps (%esi,%eax,4),%xmm4 movlps (%esi,%ecx,4),%xmm5 movss 8(%esi,%eax,4),%xmm2 movss 8(%esi,%ecx,4),%xmm6 movhps (%esi,%ebx,4),%xmm4 movhps (%esi,%edx,4),%xmm5 movss 8(%esi,%ebx,4),%xmm0 movss 8(%esi,%edx,4),%xmm1 shufps $0,%xmm0,%xmm2 shufps $0,%xmm1,%xmm6 movaps %xmm4,%xmm0 movaps %xmm4,%xmm1 shufps $136,%xmm6,%xmm2 ## constant 10001000 shufps $136,%xmm5,%xmm0 ## constant 10001000 shufps $221,%xmm5,%xmm1 ## constant 11011101 ## move ix-iz to xmm4-xmm6 movaps nb130nf_ix(%esp),%xmm4 movaps nb130nf_iy(%esp),%xmm5 movaps nb130nf_iz(%esp),%xmm6 ## calc dr subps %xmm0,%xmm4 subps %xmm1,%xmm5 subps %xmm2,%xmm6 ## square it mulps %xmm4,%xmm4 mulps %xmm5,%xmm5 mulps %xmm6,%xmm6 addps %xmm5,%xmm4 addps %xmm6,%xmm4 ## rsq in xmm4 movaps nb130nf_krf(%esp),%xmm7 rsqrtps %xmm4,%xmm5 ## lookup seed in xmm5 movaps %xmm5,%xmm2 mulps %xmm5,%xmm5 movaps nb130nf_three(%esp),%xmm1 mulps %xmm4,%xmm5 ## rsq*lu*lu movaps nb130nf_half(%esp),%xmm0 mulps %xmm4,%xmm7 ## xmm7=krsq subps %xmm5,%xmm1 ## constant 30-rsq*lu*lu mulps %xmm2,%xmm1 mulps %xmm1,%xmm0 ## xmm0=rinv movaps %xmm0,%xmm1 mulps %xmm0,%xmm3
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