[gmx-users] settle for other solvents
christoph.freudenberger at chemie.uni-ulm.de
Tue Feb 18 12:06:13 CET 2003
Thanks everybody for the information,
I think it would be best to use the lincs approach then for all
types of solvents to have consitency in all systems.
Is it possible to restrict the constraints to the solvent and
leave the solutes unaffected? Didn't find anything in the
manual about that.
Abt. Organische Chemie I AK Siehl - Uni Ulm -Tel: ++49-731-502-2785
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