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📄 nb_kernel302_ia32_3dnow.s

📁 最著名最快的分子模拟软件
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        pfmul nb302nf_tsc(%esp),%mm0        pf2iw %mm0,%mm4        movd %mm4,nb302nf_n1(%esp)        pi2fd %mm4,%mm4        pfsub %mm4,%mm0              ## now mm0 is eps and mm4 n0         movq  %mm0,%mm2        pfmul %mm2,%mm2         ## mm0 is eps, mm2 eps2         ## coulomb table         movl nb302nf_VFtab(%ebp),%edx        movl nb302nf_n1(%esp),%ecx        shll $2,%ecx        ## load all values we need         movd (%edx,%ecx,4),%mm4        movd 4(%edx,%ecx,4),%mm5        movd 8(%edx,%ecx,4),%mm6        movd 12(%edx,%ecx,4),%mm7        pfmul %mm0,%mm6 ## mm6 = Geps                   pfmul %mm2,%mm7 ## mm7 = Heps2         pfadd %mm6,%mm5        pfadd %mm7,%mm5 ## mm5 = Fp         pfmul %mm0,%mm5 ## mm5=eps*Fp         pfadd %mm4,%mm5 ##  mm5= VV         pfmul nb302nf_qqOO(%esp),%mm5   ## vcoul=qq*VV         ## update vctot directly, use mm3 for fscal sum.         pfadd nb302nf_vctot(%esp),%mm5        movq %mm5,nb302nf_vctot(%esp)        ## time for hydrogens!         movq nb302nf_tmprsqH(%esp),%mm0        pfrsqrt %mm0,%mm1        pswapd %mm0,%mm0        pfrsqrt %mm0,%mm2        pswapd %mm0,%mm0        punpckldq %mm2,%mm1     ## seeds are in mm1 now, and rsq in mm0.         movq %mm1,%mm2        pfmul %mm1,%mm1        pfrsqit1 %mm0,%mm1        pfrcpit2 %mm2,%mm1      ## mm1=invsqrt         pfmul %mm1,%mm0         ## mm0=r         pfmul nb302nf_tsc(%esp),%mm0        pf2iw %mm0,%mm4        movq %mm4,nb302nf_n1(%esp)        pi2fd %mm4,%mm4        pfsub %mm4,%mm0              ## now mm0 is eps and mm4 n0         movq  %mm0,%mm2        pfmul %mm2,%mm2         ## mm0 is eps, mm2 eps2         ## coulomb table         movl nb302nf_VFtab(%ebp),%edx        movl nb302nf_n1(%esp),%ecx        shll $2,%ecx        ## load all values we need         movd (%edx,%ecx,4),%mm4        movd 4(%edx,%ecx,4),%mm5        movd 8(%edx,%ecx,4),%mm6        movd 12(%edx,%ecx,4),%mm7        movl nb302nf_n1+4(%esp),%ecx        shll $2,%ecx        punpckldq (%edx,%ecx,4),%mm4        punpckldq 4(%edx,%ecx,4),%mm5        punpckldq 8(%edx,%ecx,4),%mm6        punpckldq 12(%edx,%ecx,4),%mm7        pfmul %mm0,%mm6 ## mm6 = Geps                   pfmul %mm2,%mm7 ## mm7 = Heps2         pfadd %mm6,%mm5        pfadd %mm7,%mm5 ## mm5 = Fp         pfmul %mm0,%mm5 ## mm5=eps*Fp         pfadd %mm4,%mm5 ##  mm5= VV         pfmul nb302nf_qqOH(%esp),%mm5   ## vcoul=qq*VV         ## update vctot         pfadd nb302nf_vctot(%esp),%mm5        movq %mm5,nb302nf_vctot(%esp)        ## interactions with j H1         movq  12(%esi,%eax,4),%mm0        movd  20(%esi,%eax,4),%mm1        ## copy & expand to mm2-mm4 for the H interactions         movq  %mm0,%mm2        movq  %mm0,%mm3        movq  %mm1,%mm4        punpckldq %mm2,%mm2        punpckhdq %mm3,%mm3        punpckldq %mm4,%mm4        pfsubr nb302nf_ixO(%esp),%mm0        pfsubr nb302nf_izO(%esp),%mm1        pfmul %mm0,%mm0        pfmul %mm1,%mm1        pfacc %mm1,%mm0        pfadd %mm1,%mm0         ## mm0=rsqO         punpckldq %mm2,%mm2        punpckldq %mm3,%mm3        punpckldq %mm4,%mm4 ## mm2-mm4 is jx-jz         pfsubr nb302nf_ixH(%esp),%mm2        pfsubr nb302nf_iyH(%esp),%mm3        pfsubr nb302nf_izH(%esp),%mm4   ## mm2-mm4 is dxH-dzH         pfmul %mm2,%mm2        pfmul %mm3,%mm3        pfmul %mm4,%mm4        pfadd %mm2,%mm3        pfadd %mm4,%mm3         ## mm3=rsqH         movq %mm3,nb302nf_tmprsqH(%esp)        pfrsqrt %mm0,%mm1        movq %mm1,%mm2        pfmul %mm1,%mm1        pfrsqit1 %mm0,%mm1        pfrcpit2 %mm2,%mm1      ## mm1=invsqrt         pfmul %mm1,%mm0         ## mm0=rsq          pfmul nb302nf_tsc(%esp),%mm0        pf2iw %mm0,%mm4        movd %mm4,nb302nf_n1(%esp)        pi2fd %mm4,%mm4        pfsub %mm4,%mm0              ## now mm0 is eps and mm4 n0         movq  %mm0,%mm2        pfmul %mm2,%mm2         ## mm0 is eps, mm2 eps2         ## coulomb table         movl nb302nf_VFtab(%ebp),%edx        movl nb302nf_n1(%esp),%ecx        shll $2,%ecx        ## load all values we need         movd (%edx,%ecx,4),%mm4        movd 4(%edx,%ecx,4),%mm5        movd 8(%edx,%ecx,4),%mm6        movd 12(%edx,%ecx,4),%mm7        pfmul %mm0,%mm6 ## mm6 = Geps                   pfmul %mm2,%mm7 ## mm7 = Heps2         pfadd %mm6,%mm5        pfadd %mm7,%mm5 ## mm5 = Fp         pfmul %mm0,%mm5 ## mm5=eps*Fp         pfadd %mm4,%mm5 ##  mm5= VV         pfmul nb302nf_qqOH(%esp),%mm5   ## vcoul=qq*VV         ## update vctot  directly, force is moved to mm3         pfadd nb302nf_vctot(%esp),%mm5        movq %mm5,nb302nf_vctot(%esp)        movq nb302nf_tmprsqH(%esp),%mm0        pfrsqrt %mm0,%mm1        pswapd %mm0,%mm0        pfrsqrt %mm0,%mm2        pswapd %mm0,%mm0        punpckldq %mm2,%mm1     ## seeds are in mm1 now, and rsq in mm0.         movq %mm1,%mm2        pfmul %mm1,%mm1        pfrsqit1 %mm0,%mm1        pfrcpit2 %mm2,%mm1      ## mm1=invsqrt         pfmul %mm1,%mm0         ## mm0=r         pfmul nb302nf_tsc(%esp),%mm0        pf2iw %mm0,%mm4        movq %mm4,nb302nf_n1(%esp)        pi2fd %mm4,%mm4        pfsub %mm4,%mm0              ## now mm0 is eps and mm4 n0         movq  %mm0,%mm2        pfmul %mm2,%mm2         ## mm0 is eps, mm2 eps2         ## coulomb table         movl nb302nf_VFtab(%ebp),%edx        movl nb302nf_n1(%esp),%ecx        shll $2,%ecx        ## load all values we need         movd (%edx,%ecx,4),%mm4        movd 4(%edx,%ecx,4),%mm5        movd 8(%edx,%ecx,4),%mm6        movd 12(%edx,%ecx,4),%mm7        movl nb302nf_n1+4(%esp),%ecx        shll $2,%ecx        punpckldq (%edx,%ecx,4),%mm4        punpckldq 4(%edx,%ecx,4),%mm5        punpckldq 8(%edx,%ecx,4),%mm6        punpckldq 12(%edx,%ecx,4),%mm7        pfmul %mm0,%mm6 ## mm6 = Geps                   pfmul %mm2,%mm7 ## mm7 = Heps2         pfadd %mm6,%mm5        pfadd %mm7,%mm5 ## mm5 = Fp         pfmul %mm0,%mm5 ## mm5=eps*Fp         pfadd %mm4,%mm5 ##  mm5= VV         pfmul nb302nf_qqHH(%esp),%mm5   ## vcoul=qq*VV         ## update vctot         pfadd nb302nf_vctot(%esp),%mm5        movq %mm5,nb302nf_vctot(%esp)        ## interactions with j H2         movq  24(%esi,%eax,4),%mm0        movd  32(%esi,%eax,4),%mm1        ## copy & expand to mm2-mm4 for the H interactions         movq  %mm0,%mm2        movq  %mm0,%mm3        movq  %mm1,%mm4        punpckldq %mm2,%mm2        punpckhdq %mm3,%mm3        punpckldq %mm4,%mm4        pfsubr nb302nf_ixO(%esp),%mm0        pfsubr nb302nf_izO(%esp),%mm1        pfmul %mm0,%mm0        pfmul %mm1,%mm1        pfacc %mm1,%mm0        pfadd %mm1,%mm0         ## mm0=rsqO         punpckldq %mm2,%mm2        punpckldq %mm3,%mm3        punpckldq %mm4,%mm4 ## mm2-mm4 is jx-jz         pfsubr nb302nf_ixH(%esp),%mm2        pfsubr nb302nf_iyH(%esp),%mm3        pfsubr nb302nf_izH(%esp),%mm4   ## mm2-mm4 is dxH-dzH         pfmul %mm2,%mm2        pfmul %mm3,%mm3        pfmul %mm4,%mm4        pfadd %mm2,%mm3        pfadd %mm4,%mm3         ## mm3=rsqH         movq %mm3,nb302nf_tmprsqH(%esp)        pfrsqrt %mm0,%mm1        movq %mm1,%mm2        pfmul %mm1,%mm1        pfrsqit1 %mm0,%mm1        pfrcpit2 %mm2,%mm1      ## mm1=invsqrt         pfmul %mm1,%mm0        pfmul nb302nf_tsc(%esp),%mm0        pf2iw %mm0,%mm4        movd %mm4,nb302nf_n1(%esp)        pi2fd %mm4,%mm4        pfsub %mm4,%mm0              ## now mm0 is eps and mm4 n0         movq  %mm0,%mm2        pfmul %mm2,%mm2         ## mm0 is eps, mm2 eps2         ## coulomb table         movl nb302nf_VFtab(%ebp),%edx        movl nb302nf_n1(%esp),%ecx        shll $2,%ecx        ## load all values we need         movd (%edx,%ecx,4),%mm4        movd 4(%edx,%ecx,4),%mm5        movd 8(%edx,%ecx,4),%mm6        movd 12(%edx,%ecx,4),%mm7        pfmul %mm0,%mm6 ## mm6 = Geps                   pfmul %mm2,%mm7 ## mm7 = Heps2         pfadd %mm6,%mm5        pfadd %mm7,%mm5 ## mm5 = Fp         pfmul %mm0,%mm5 ## mm5=eps*Fp         pfadd %mm4,%mm5 ##  mm5= VV         pfmul nb302nf_qqOH(%esp),%mm5   ## vcoul=qq*VV         ## update vctot directly, use mm3 for fscal sum.         pfadd nb302nf_vctot(%esp),%mm5        movq %mm5,nb302nf_vctot(%esp)        movq nb302nf_tmprsqH(%esp),%mm0        pfrsqrt %mm0,%mm1        pswapd %mm0,%mm0        pfrsqrt %mm0,%mm2        pswapd %mm0,%mm0        punpckldq %mm2,%mm1     ## seeds are in mm1 now, and rsq in mm0.         movq %mm1,%mm2        pfmul %mm1,%mm1        pfrsqit1 %mm0,%mm1        pfrcpit2 %mm2,%mm1      ## mm1=invsqrt         pfmul %mm1,%mm0         ## mm0=r         pfmul nb302nf_tsc(%esp),%mm0        pf2iw %mm0,%mm4        movq %mm4,nb302nf_n1(%esp)        pi2fd %mm4,%mm4        pfsub %mm4,%mm0              ## now mm0 is eps and mm4 n0         movq  %mm0,%mm2        pfmul %mm2,%mm2         ## mm0 is eps, mm2 eps2         ## coulomb table         movl nb302nf_VFtab(%ebp),%edx        movl nb302nf_n1(%esp),%ecx        shll $2,%ecx        ## load all values we need         movd (%edx,%ecx,4),%mm4        movd 4(%edx,%ecx,4),%mm5        movd 8(%edx,%ecx,4),%mm6        movd 12(%edx,%ecx,4),%mm7        movl nb302nf_n1+4(%esp),%ecx        shll $2,%ecx        punpckldq (%edx,%ecx,4),%mm4        punpckldq 4(%edx,%ecx,4),%mm5        punpckldq 8(%edx,%ecx,4),%mm6        punpckldq 12(%edx,%ecx,4),%mm7        pfmul %mm0,%mm6 ## mm6 = Geps                   pfmul %mm2,%mm7 ## mm7 = Heps2         pfadd %mm6,%mm5        pfadd %mm7,%mm5 ## mm5 = Fp         pfmul %mm0,%mm5 ## mm5=eps*Fp         pfadd %mm4,%mm5 ##  mm5= VV         pfmul nb302nf_qqHH(%esp),%mm5   ## vcoul=qq*VV         ## update vctot         pfadd nb302nf_vctot(%esp),%mm5        movq %mm5,nb302nf_vctot(%esp)        ##  done  - one more?         decl nb302nf_innerk(%esp)        jz  _nb_kernel302nf_ia32_3dnow.nb302nf_updateouterdata        jmp _nb_kernel302nf_ia32_3dnow.nb302nf_inner_loop_nb_kernel302nf_ia32_3dnow.nb302nf_updateouterdata:         ## get n from stack        movl nb302nf_n(%esp),%esi        ## get group index for i particle         movl  nb302nf_gid(%ebp),%edx            ## base of gid[]        movl  (%edx,%esi,4),%edx                ## ggid=gid[n]        movq  nb302nf_vctot(%esp),%mm7        pfacc %mm7,%mm7           ## get and sum the two parts of total potential         movl  nb302nf_Vc(%ebp),%eax        movd  (%eax,%edx,4),%mm6        pfadd %mm7,%mm6        movd  %mm6,(%eax,%edx,4)          ## increment vc[gid]         ## finish if last         movl nb302nf_nn1(%esp),%ecx        ## esi already loaded with n        incl %esi        subl %esi,%ecx        jz _nb_kernel302nf_ia32_3dnow.nb302nf_outerend        ## not last, iterate outer loop once more!          movl %esi,nb302nf_n(%esp)        jmp _nb_kernel302nf_ia32_3dnow.nb302nf_outer_nb_kernel302nf_ia32_3dnow.nb302nf_outerend:         ## check if more outer neighborlists remain        movl  nb302nf_nri(%esp),%ecx        ## esi already loaded with n above        subl  %esi,%ecx        jz _nb_kernel302nf_ia32_3dnow.nb302nf_end        ## non-zero, do one more workunit        jmp   _nb_kernel302nf_ia32_3dnow.nb302nf_threadloop_nb_kernel302nf_ia32_3dnow.nb302nf_end:         femms        movl nb302nf_nouter(%esp),%eax        movl nb302nf_ninner(%esp),%ebx        movl nb302nf_outeriter(%ebp),%ecx        movl nb302nf_inneriter(%ebp),%edx        movl %eax,(%ecx)        movl %ebx,(%edx)        addl $128,%esp        popl %edi        popl %esi        popl %edx        popl %ecx        popl %ebx        popl %eax        leave        ret

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