Re: [AMBER] rmsd calculations on multiple trajectories

From: Carlos Simmerling <carlos.simmerling.gmail.com>
Date: Fri, 29 Jul 2016 11:47:23 -0400

Thanks for the clarification Dan!

On Jul 29, 2016 11:36 AM, "Daniel Roe" <daniel.r.roe.gmail.com> wrote:

> On Fri, Jul 29, 2016 at 9:30 AM, Carlos Simmerling
> <carlos.simmerling.gmail.com> wrote:
> > my guess is that cpptraj is not set up to load an arbitrary number of
> > prmtop files,
>
> Cpptraj can load as many topology files as memory will allow. Loading
> multiple topology files was actually one of my primary motivations for
> writing cpptraj in the first place :-)
>
> -Dan
>
> --
> -------------------------
> Daniel R. Roe, PhD
> Department of Medicinal Chemistry
> University of Utah
> 30 South 2000 East, Room 307
> Salt Lake City, UT 84112-5820
> http://home.chpc.utah.edu/~cheatham/
> (801) 587-9652
> (801) 585-6208 (Fax)
>
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Received on Fri Jul 29 2016 - 09:00:05 PDT
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