Fixed potential error in coulomb energy, and maybe segfaults for small molecules...
commit312e8a508db41f3c1fb6e8d86d600e6de009d10c
authorErik Lindahl <lindahl@cbr.su.se>
Tue, 17 Aug 2010 18:13:29 +0000 (17 20:13 +0200)
committerErik Lindahl <lindahl@cbr.su.se>
Tue, 17 Aug 2010 18:13:29 +0000 (17 20:13 +0200)
tree008b51ae222271fcc9bfa7caa2a776abf612e540
parent2c2abe3f4b2a74053cda9769b885ba662d02c973
Fixed potential error in coulomb energy, and maybe segfaults for small molecules in all-vs-all kernels
src/gmxlib/nonbonded/nb_kernel_x86_64_sse/nb_kernel_allvsall_sse2_single.c
src/gmxlib/nonbonded/nb_kernel_x86_64_sse/nb_kernel_allvsallgb_sse2_single.c