[AMBER] Polymorphism study using Amber

From: jacob wick <jacobwick.la.gmail.com>
Date: Mon, 18 May 2015 12:23:29 +0530

Hi All,

I have two crystals of polymorphs (having same composition but different
crystal structure).

I want to know which one is more stable. Is it possible to analyse which
one is more stable than the other using amber.

I believe that simple minimization of the two systems and analyzing the
energy profile, I can conclude that which one is more stable.

Any suggestions?

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Received on Mon May 18 2015 - 00:00:02 PDT
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