Hello –

 

Please send us your input and PQR files so we can debug.

 

Thanks,

 

__________________________________________________
Nathan Baker
Pacific Northwest National Laboratory
Tel:  +1-509-375-3997

http://nabaker.me

 

From: Nicholas Wright [mailto:nwwright@usc.edu]
Sent: Friday, March 16, 2012 3:18 PM
To: apbs-users@googlegroups.com; apbs-users@lists.sourceforge.net
Subject: [apbs-users] off grid error

 

I have recently gotten an "atom is off grid (ignoring)" return when running apbs.  I have double checked cglen and fglen in my input file and I seem to have my entire molecule on the grid.  Is there some setting i am missing?

 

--
Sincerely,
Nicholas W. Wright


University of Southern California
Class of 2012 - Chemical Engineering Nanotechnology
President Emeritus - Theta Xi - Alpha Nu Chapter