[gmx-users] solvation

[Justin A. Lemkul]

Jamie Seyed wrote:
>
> 
>     Is it giving a seg fault when using a proper .gro file?  I don't
>     understand what you're asking about.
> 
> yes, using a proper one...

Well, the only time I've seen a seg fault with genbox -ci -nmol was when I was 
asking genbox to something that it couldn't (i.e., not enough space for all the 
molecules).  Is there really enough space for any amount of water molecules in 
the configuration you are working with?

-Justin

-- 
========================================

Justin A. Lemkul
Ph.D. Candidate
ICTAS Doctoral Scholar
Department of Biochemistry
Virginia Tech
Blacksburg, VA
jalemkul[at]vt.edu | (540) 231-9080
http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin

========================================