Re: [AMBER] using boundary information from previous run

From: Daniel Roe <daniel.r.roe.gmail.com>
Date: Fri, 30 Sep 2016 08:25:10 -0400

Hi,

On Fri, Sep 30, 2016 at 4:53 AM, Hirdesh Kumar <hirdesh.iitd.gmail.com> wrote:
> .Dac: My restart file is netcdf formatted so I can not visualize it using
> vi editor. As an alternate, I generated the inpcrd file and checked the
> last line.

FYI you could also use 'ncdump -v <variable> <file>' where <variable>
is either 'cell_lengths' or 'cell_angles' to get the box
lengths/angles from a NetCDF restart.

-Dan

-- 
-------------------------
Daniel R. Roe
Laboratory of Computational Biology
National Institutes of Health, NHLBI
5635 Fishers Ln, Rm T900
Rockville MD, 20852
https://www.lobos.nih.gov/lcb
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Received on Fri Sep 30 2016 - 05:30:05 PDT
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