[gmx-users] (no subject)
David van der Spoel
spoel at xray.bmc.uu.se
Wed Mar 20 21:12:18 CET 2002
On Wed, 20 Mar 2002, Atom News wrote:
>
>
>Dear All,
>
>is it possible to have a set of atomic coordinates which have not been
>subjected to pbc during the simulation?
It's all or nothing. All PBC or none.
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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