Re: [AMBER] Opening mol2 file in xleap

From: FyD <fyd.q4md-forcefieldtools.org>
Date: Wed, 25 May 2016 09:04:29 +0200

Dear Nikolay,

> I want to start MD simulation of a ligand-receptor complex written in mol2
> file. Is it possible to open it in xleap?..

See http://upjv.q4md-forcefieldtools.org/Tutorial/leap-mol2.php
     http://upjv.q4md-forcefieldtools.org/Tutorial/leap-mol3.php

regards, Francois


           F.-Y. Dupradeau
                 ---
http://q4md-forcefieldtools.org/FyD/


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Received on Wed May 25 2016 - 00:30:02 PDT