Fixed a bug in the all-vs-all sse gb kernels, where an exclusion mask was
commitc09840c8e2190cf6e2914e9ebdf41f2151690abd
authorPer Larsson <per.larsson@sbc.su.se>
Thu, 28 Oct 2010 18:44:59 +0000 (28 20:44 +0200)
committerPer Larsson <per.larsson@sbc.su.se>
Thu, 28 Oct 2010 18:44:59 +0000 (28 20:44 +0200)
treebf2d7ceb635702b1ed1e193f746c89cc68629d52
parent54df554d269aac97578bf44aaebeede1b7f64c93
Fixed a bug in the all-vs-all sse gb kernels, where an exclusion mask was
calculated incorrectly. Also fixes to loop indeces in the all-vs-all non-sse
code.
src/gmxlib/nonbonded/nb_kernel_ia32_sse2/nb_kernel_allvsallgb_sse2_double.c
src/gmxlib/nonbonded/nb_kernel_x86_64_sse2/nb_kernel_allvsallgb_sse2_double.c
src/mdlib/genborn.c
src/mdlib/genborn_allvsall.c