[gmx-users] freezegroups and pressure

David van der Spoel spoel at xray.bmc.uu.se
Tue Mar 12 21:59:09 CET 2002


Another thing to check is your center of mass groups. The freeze group
should overlap with the center of mass group (be identical) otherwise the
particles will move anyway.

Groeten, David.
________________________________________________________________________
Dr. David van der Spoel, 	Biomedical center, Dept. of Biochemistry
Husargatan 3, Box 576,  	75123 Uppsala, Sweden
phone:	46 18 471 4205		fax: 46 18 511 755
spoel at xray.bmc.uu.se	spoel at gromacs.org   http://zorn.bmc.uu.se/~spoel
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