[gmx-users] Add new post-processing features in Gromacs

Tandia, Adama TandiaA at Corning.com
Tue Oct 6 23:50:49 CEST 2009


I would like to know if the details of how to add new post-processing
features in Gromacs had been already discussed or described somewhere.
I have in mind things like angle distribution, structure factor, and
incoherent intermediate scattering function, to name a few, for glassy

Does anyone know of a package that could compute those properties from a
Gromacs trajectory files?



Adama Tandia, Corning INC, SP-TD-01-01 Corning NY 14831 USA, Tel: 607
248 1036 -GoogleVoice: 708 433 9430

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