[gmx-users] Nucl. Acids Force-Field Importation???

Anton Feenstra feenstra at chem.vu.nl
Fri Mar 1 14:08:51 CET 2002


David van der Spoel wrote:
> 
> It would be nicest is you could indeed make a program (preferably C
> or Perl) to transform the force field files into gromacs format. In the
> not so distant future I will start to transform all these kind of data
> files into XML, but then I will have to convert the old files
> automatically as well. It would be nice if we had some kind of CNS input
> reader that we could hook into this conversion tool, such that we can
> convert future CNS and or AMber force fields into gromacs without
> intermediate steps.

Do they keep file formats unchanged over versions?

-- 
Groetjes,

Anton
 ________ ___________________________________________________________
|        | Anton Feenstra                                            |
| .      | Dept. of Pharmacochemistry - Free University Amsterdam    |
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| ' __   | Feenstra at chem.vu.nl - http://www.chem.vu.nl/afdelingen/FAR|
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