AMBER Archive (2009)

Subject: Re: [AMBER] Dimethyl Sulfoxide (DMSO) cartesian coordinates?

From: Bill Ross (ross_at_cgl.ucsf.edu)
Date: Tue Aug 18 2009 - 17:59:12 CDT

> I am trying to use DMSO in my simulations. I obtained frcmod and lib files,
> but I need the atomic coordinates.

In leap, savePdb DMSO (however it is named).

Those are the crds in the lib file, for whatever they are worth.

Bill

_______________________________________________
AMBER mailing list
AMBER_at_ambermd.org
http://lists.ambermd.org/mailman/listinfo/amber