AMBER Archive (2004)

Subject: Re: AMBER: How to remove Cl- ions

From: Bill Ross (ross_at_cgl.ucsf.edu)
Date: Fri Feb 06 2004 - 10:35:27 CST


> Can anybody help me to remove Cl- ions from prmtop file and mdcrd file?

Carnal and ptraj can be used for mdcrd, for prmtop either make a new
one as described or possibly rdparm can do it.

Bill

-----------------------------------------------------------------------
The AMBER Mail Reflector
To post, send mail to amber_at_scripps.edu
To unsubscribe, send "unsubscribe amber" to majordomo_at_scripps.edu