[gmx-users] Terminal groups problem

[Anton Feenstra]

Oleg V. Stroganov wrote:
> So, I want Gromacs to 1) recognize all terminal groups and 2) automatically add
> dummy constructions for terminal NH2 group.

Have you tried 'pdb2gmx -debug'? That generates a pdb2gmx.log file with
lots of (sometimes useful) information.


-- 
Groetjes,

Anton
  _____________ _______________________________________________________
|             |                                                       |
|  _   _  ___,| K. Anton Feenstra                                     |
| / \ / \'| | | Dept. of Pharmacochem. - Vrije Universiteit Amsterdam |
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