[gmx-users] Average pdb coordinates
Erik Marklund
erikm at xray.bmc.uu.se
Wed Jun 16 14:09:13 CEST 2010
Try g_covar. Note, however, that average coordinates are mostly meaningless.
Erik
rituraj purohit skrev:
> Dear Friends
>
> To get coordinates at specific ps i used to use following command
>
> trjconv -f md.xtc -s md.tpr -o 2000.pdb -dump 2000
>
> *I want average pdb coordinates between 0ps to 2000ps, How i can get it ?*
>
> Regards
> Rituraj
>
>
>
--
-----------------------------------------------
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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