[gmx-users] Re: graph edges problem
sir_donald_bradman at yahoo.com
Thu May 18 17:00:52 CEST 2006
oops, i just saw berk hess's message that using
pbc=full will circumvent this problem. however,
pbc=full is incompatible with shake, right? and my
solvent has coupled angle constraints which stuff up
lincs. any other way around the problem?
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