Added a check in grompp for the case with particles having a non-zero
commit8a95cc08982ea2c7decc293ecb53f76d09f85a59
authorPer Larsson <per.larsson@sbc.su.se>
Fri, 22 Oct 2010 08:31:02 +0000 (22 10:31 +0200)
committerPer Larsson <per.larsson@sbc.su.se>
Fri, 22 Oct 2010 08:31:02 +0000 (22 10:31 +0200)
tree6e6eb4898abd46fb785a7d8c9f05f238550a45a3
parentc493a23d1438078062a0fbe980605c51d3413567
Added a check in grompp for the case with particles having a non-zero
charge while all GB-parameters are set to zero. This fixes bug #599.
src/kernel/grompp.c