AMBER Archive (2004)

Subject: AMBER: Carnal

From: Herbert Georg (hcgeorg_at_if.usp.br)
Date: Tue Feb 03 2004 - 10:11:28 CST


Is there any way to calculate the dipole moments with carnal?? I know
that ptraj does it but it would be useful to do it by Carnal too because
in carnal I could manipulate this data, for example calculating the
angle between the dipole moment and a plane (whose normal vector can be
calculated by carnal).

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