[gmx-users] Pull code with angle constraints

Vojtěch Spiwok Vojtech.Spiwok at vscht.cz
Thu Jun 15 09:36:53 CEST 2006


Dear gromacs gurus

I wonder to know if there is some
straightforward way to implement
angle, dihedral and possibly other
constraints to the pull code, beside
distance constraints. Any idea would
help.

Sincerely

Vojtech Spiwok

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Ing. Vojtech Spiwok, PhD.
Dept. of Biochemistry and Microbiology
Institute of Chemical Technology Prague
Technicka 3, Prague 6, 166 28,
Czech Republic
Tel: +420 22044 3028
Fax: +420 22044 5167
E-mail: spiwokv at vscht.cz
Web: biomikro.vscht.cz/groups/lab211/
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