On 7/31/13 3:59 AM, Mark Abraham wrote:
What does your background reading suggest is a good choice for VDW type?
In addition, what does the chosen force field require?
-Justin
Mark
On Wed, Jul 31, 2013 at 9:18 AM, Mahboobeh Eslami
<mahboobeh.esl...@yahoo.com> wrote:
hi all freind
what is vdwtype in mdp file for LIE method in free energy calculation?
best regard
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Justin A. Lemkul, Ph.D.
Postdoctoral Fellow
Department of Pharmaceutical Sciences
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