AMBER Archive (2009)Subject: [AMBER] Distance restraints between groups of atoms
From: Germain Vallverdu (germain.vallverdu_at_lcp.u-psud.fr)
Date: Wed Jun 03 2009 - 01:58:57 CDT
Dear amber users,
I would like to add a restraint on a distance between, one atom and a
group of atoms. I know how to put any restraint on one ore more
distances angles dihedral ect but I do not understand the syntax for
group of atoms. The manual says that I have to put a negative values of
iat1. But what next ? How do I distinguish the two groups or one groups
and an atom ?
Thanks
Germain
--
Germain Vallverdu
Doctorant
Laboratoire de Chimie Physique
germain.vallverdu_at_lcp.u-psud.fr
PagePerso
01 69 15 30 38
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