GROMACS additions for the incorporation of S2 and pairwise NOE distance restraints
- Present additions are written for GROMACS 3.3.1
- Installation instructions can be found in the file 'INSTALL' provided with the package.
- Download tarball with additions
- Any questions, suggestions and comments are welcome! (szpari at chem.elte.hu)
- If you find these additions useful and publish data obtained with it, you are kindly asked to cite the paper
Related publications
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Gyula Batta
, Herbert Lindner
, István Pócsi
, Nikoletta Hegedüs
, Éva Leiter
, Andrea Eigentler
, Anil Kumar Chhillar
, Lydia Kaiserer
, Bettina Sarg
, Ulrike Binder
, Katalin E. Kövér
, Szabolcs Sándor
, Zoltán Gáspári
, Teréz Barna
, Florentine Marx
Functional Aspects of the Solution Structure and Dynamics of PAF, a Highly Stable Antifungal Protein from Penicillium chrysogenum
FEBS J.
276:2875-2890. (2009)
Kivonat