From: Norman Geist (norman.geist_at_uni-greifswald.de)
Date: Thu Feb 28 2013 - 09:05:59 CST
Try catdcd. It provides multiple ascii modes like the amber trj or multipdb.
Norman Geist.
Von: owner-namd-l_at_ks.uiuc.edu [mailto:owner-namd-l_at_ks.uiuc.edu] Im Auftrag
von Daniel Abergel
Gesendet: Donnerstag, 28. Februar 2013 14:05
An: namd-l_at_ks.uiuc.edu
Betreff: namd-l: converting dcd files to netcdf or ascii
Hello,
I am using the command forceDCDfile to calculate the forces acting on each
atom during a protein MD simulation with namd2.8.
I need to translate these into ascii files but I can't figure out how.
Does any body have an answer ?
Thanks a lot
DA
-- Daniel Abergel Département de Chimie Ecole Normale Supérieure 24, rue Lhomond, 75005 Paris Tel.: +33 1 44 32 33 44 email: daniel.abergel_at_ens.fr
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