[gmx-developers] trjconv defaults

David van der Spoel spoel at xray.bmc.uu.se
Fri Oct 17 10:19:08 CEST 2008


Hi,

shall we set the trjconv defaults to -pbc mol -ur compact ?
Even I get fooled when dumping a pdb file and suddenly noticing that it 
is broken.

Cheers,
-- 
David.
________________________________________________________________________
David van der Spoel, PhD, Professor of Biology
Dept. of Cell and Molecular Biology, Uppsala University.
Husargatan 3, Box 596,  	75124 Uppsala, Sweden
phone:	46 18 471 4205		fax: 46 18 511 755
spoel at xray.bmc.uu.se	spoel at gromacs.org   http://folding.bmc.uu.se
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