On 28/11/2011 10:13 PM, yp sun wrote:
Dear Sir,
When I run pdb2gmx, I encounter the following error information:
Program pdb2gmx, VERSION 3.3.1
Source code file: genhydro.c, line: 304
Fatal error:
Atom CB not found in residue ASP223 while adding hydrogens
What should I do?
Probably update to a much faster GROMACS version, check out
http://www.gromacs.org/Documentation/Errors#Atom_X_in_residue_YYY_not_found_in_rtp_entry,
and follow the guidelines here for making posts
http://www.gromacs.org/Support :-)
Mark
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