On Wed, Aug 20, 2014 at 8:22 AM, Sourav Purohit <sour000.gmail.com> wrote:
> Hi all.
> Is there some way to calculate contacts between atoms of two different
> masks using ptraj?
>
​Look at the "nativecontacts" and "contacts" commands in cpptraj. They are
described in the cpptraj chapter of the AmberTools 14 manual.
HTH,
Jason
--
Jason M. Swails
BioMaPS,
Rutgers University
Postdoctoral Researcher
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Received on Wed Aug 20 2014 - 06:00:04 PDT
