[AMBER] Constraint minimisation before MD simulation

From: Amire-Brahimi Benjamin <bxa8300.louisiana.edu>
Date: Tue, 27 Apr 2010 16:48:31 -0500

Dear mailing list,

Do we have to perform a constraint minimisation of the added hydrogen and
water box molecules, and ions before an MD production run?

Thanks,


Ben

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Received on Tue Apr 27 2010 - 15:00:03 PDT