Re: [AMBER] Asking for help: cross linking polymer

From: David A Case <david.case.rutgers.edu>
Date: Tue, 7 Jul 2020 21:42:53 -0400

On Tue, Jul 07, 2020, SAKO MIRZAIE wrote:
>
>...my polymer has a cross- link and I don’t know how can I define the
>cross link by LEAP module in ambertools.

Use the "bond" command in tleap to define cross-links that you wish to add.

...dac


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Received on Tue Jul 07 2020 - 19:00:02 PDT
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