[gmx-users] pdb structure file at particular time(ps)

Erik Marklund erikm at xray.bmc.uu.se
Thu Mar 3 12:03:20 CET 2011


ajaniharesh at gmail.com skrev 2011-03-03 12.00:
> Hello everyone,
>
> I have done simulation of 2ns.
>
> Then I have analyised it. Everything is fine.but I have 1 query releted pdb structure.
>
> I want pdb structure @ paticular time(ps).
>
> I have run trjconv command and got pdb structure @ every 2 ps.
>
> But I want pdb structure @ 265.4 ps
>
> What i should do for this problem ?
>
> Give me any command please.
>
> Thanks and regards
>
> Sent from my Nokia phone
try trjconv -dump

-- 
-----------------------------------------------
Erik Marklund, PhD student
Dept. of Cell and Molecular Biology, Uppsala University.
Husargatan 3, Box 596,    75124 Uppsala, Sweden
phone:    +46 18 471 4537        fax: +46 18 511 755
erikm at xray.bmc.uu.se    http://folding.bmc.uu.se/




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