[AMBER] about Paramfit

From: Albert <mailmd2011.gmail.com>
Date: Fri, 6 Oct 2017 23:03:21 +0200

Hello,

I am following Paramfit tutorial

  http://ambermd.org/tutorials/advanced/tutorial23/paramfit_7.html

However, I noticed that it need Gaussian for the QM calculation. I am
just wondering is it possible to use other QM software such as ORCA
which is free for this step? I don't have a license for Gaussian.

Thank you very much.

Albert

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Received on Fri Oct 06 2017 - 14:30:02 PDT
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