Dear Sir,
Thanks for your reply. The problem is at charmmlipid2amber step and the
output file was not generated for the following command.
$ charmmlipid2amber.py –i rec.pdb [-c substitution_definitions.csv] \ -o
rec2.pdb
The system shows the following message without showing any error
Usage: charmmlipid2amber.py [-c charmmlipid2amber.csv] -i input.pdb -o
output.pdb
Thanks & regards
*Dr. Ramesh M*
Email: shreeramesh.gmail.com
Mobile: (91) + 9646469938 (27) + (0) 844556164
On Fri, Apr 15, 2016 at 5:03 AM, David A Case <david.case.rutgers.edu>
wrote:
> On Fri, Apr 15, 2016, Shreeramesh wrote:
> >
> > I use the following script for the conversion and was unsuccessful.
>
> It would be most helpful if you could indicate what the symptoms of the
> problem are. It's not even clear (at least to me) whether the error was
> in the charmmlipid2amber step or the tleap step.
>
> ...thx...dac
>
>
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Received on Fri Apr 15 2016 - 05:30:07 PDT
