On 26/07/2012 9:21 PM, Arunima Kumar wrote:
Dear Sir
I am Arunima Kumar Verma......a researcher from India. I found your
email id from mailing list mentioned in GROMACS.
Then you will have seen there the frequent requests from people not to
make personal requests for help on general GROMACS topics.
I need your urgent help. Actually i have been striving hard to solve
the problems i am facing in molecular dynamics simulation of my protein.
Your need is urgent to me when you're paying me ;-)
Being from pure biological sciences background and qulaified
CSIR-NET...........i am more acquainted with life sciences. Though i
have done my PG in bioinformatic yet i have problems
in computational aspects. Sir, presently i have put my protein
molecule to simulation by GROMACS and facing problems while
running grompp or mdrun commands. I earnestly request if you can help
in creating SGE script for the same. I would be highly obliged sir.
Plz help
You should start by doing all the tutorial material you can find with
Google, even if you don't think the tutorial topic is particularly
relevant, and reading as widely as possible, particularly including the
manual.
Mark
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