AMBER Archive (2002)

Subject: GENERALIZED BORN model on a protein with Fe

From: Mahadevan Seetharaman (maha_at_vi1.medc.umn.edu)
Date: Thu Jul 18 2002 - 09:55:01 CDT


HI,

Can the GENERALIZED BORN model handle HEME. When I tried running I got
the following error message

---
The NAMELIST READ statement cannot be completed because an incorrect
charact er was encountered in a NAMELIST group name or item name.  The
program will recover by discontinuing further processing of the READ
statement.

bad atom type: FE ---

Thanx Mahadevan