[gmx-users] The file

Elias santos silvasantosster at gmail.com
Mon Aug 14 21:37:47 CEST 2006


HI! I have a problem.

 I am working with a molecule that will count two clusters, co-ordinated for
cysteins.

But in the pdb file does not exist linkings between iron atoms and of the
cystens, even so literature affirms that it exists.

How I can edit this file?
 Therefore when I edited it even so it has if visualized the linkings in
this format (pdb), when processing it with pdb2gmx the linkings
between irons and atoms SG of the cisteínas these linkings do not appear in
the topology archive. What it can be?

E, Silva
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