Re: [AMBER] cpptraj surf

From: Jason Swails <>
Date: Fri, 24 Aug 2012 11:47:59 -0400

On Fri, Aug 24, 2012 at 11:28 AM, George Tzotzos <> wrote:

> Thank you Dan,
> I think that 'molsurf' is not implemented by cpptraj. I assume that in
> order to use 'molsurf' I shall have to build up the molecules using NAB. Am
> I right in this?

No. Check the 'molsurf' command in the AmberTools manual for cpptraj.
 Cpptraj handles molsurf.


Jason M. Swails
Quantum Theory Project,
University of Florida
Ph.D. Candidate
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Received on Fri Aug 24 2012 - 09:00:03 PDT
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