[gmx-users] partial charge on protein

Homa Azizian hazizian at razi.tums.ac.ir
Mon Apr 6 21:07:55 CEST 2009

according to my problem about non-neglible magnitude partial charge on 
protein, I did not use -missing option with pdb2gmx my command is:
pdb2gmx -ignh -f .pdb -o .pdb -water spce
what should I do to neutralize this charge?
Thank you in advance.
Tehran University of Medical Sciences

This message has been scanned for viruses and
dangerous content by MailScanner, and is
believed to be clean.

More information about the gromacs.org_gmx-users mailing list