Fe2+ parameters?

From: Georgios Papadopoulos (papg_at_chem.auth.gr)
Date: Sun Jun 05 2005 - 04:52:09 CDT

Does anybody know, how to add Fe++ in a protein solvent environment
for a subsequent simulation with NAMD? Unfortunately psfegen can not
handle Fe++, presumably because it does not appear as RESI in
top_all27_prot_na.inp. Is there any supplement of it?

Thanks in advance


This archive was generated by hypermail 2.1.6 : Wed Feb 29 2012 - 15:40:48 CST