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tripplab edited this page Feb 7, 2017 · 28 revisions

Aquí puedes encontrar los procedimientos utilizados para modelar el complejo enzima-sustrato
*Docking
*Parametrización del sustrato

You will need (or similar):

GROMACS
VMD
ROSETTA
ROBETTA
[Molden] (http://www.cmbi.ru.nl/molden/)
[GAMESS] (http://www.msg.chem.iastate.edu/GAMESS/)
[Autodock vina] (http://vina.scripps.edu/)
[Autodock Tools] (http://mgltools.scripps.edu/)
[Discovery Studio] (http://accelrys.com/products/collaborative-science/biovia-discovery-studio/)

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