[gmx-developers] Marto Carle routine for Gromacs

Anthony Costa anthony.costa at gmail.com
Tue Sep 28 01:16:33 CEST 2010

2010/9/27 André Assunção S. T. Ribeiro <aastr at yahoo.com.br>:
> Yes, I've been working on it. Feel free to contact me if you want to discuss
> the status of the implementation or want to cooperate.

I would be interested in the status here, and would be willing to help
the effort as I can. I've done some work with established monte carlo
integrators, enabling the use of modern all-atom forcefields such that
things like chirality inversion in proteins, cold fusion, etc., are
properly treated. Though, I have little experience with the Gromacs
source (especially v. 4).

All the best,

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