[AMBER] About APBS radiopt

From: Youn Kyeung Lee <0simlee.gmail.com>
Date: Mon, 28 Dec 2009 19:12:07 +0900


I have a question about radiopt in APBS.
In manual, it says, if I set radiopt as 0, the radii from prmtop files are
used for PB calculation.
I wonder that APBS also reads charges from prmtop file.
Do I need another file for setting the same charges as those in prmtop file?

Thank U
AMBER mailing list
Received on Mon Dec 28 2009 - 02:30:05 PST
Custom Search