[gmx-users] Example of H REMD

[Sanja Zivanovic]

Dear users,

Could you please send me some example of inputs for Hamiltonian Replica
exchange? It would be great if you can write me command line and attach mdp
file. I would like to make H REMD for following ligand.

Thanks in advance a lot

Best Regards, Sanja


-- 
*Sanja Zivanovic*
PhD Student
https://www.linkedin.com/in/sanjazivanovic

Molecular Modelling and Bioinformatics Laboratory
Institute for Research in Biomedicine (IRB Barcelona)
Parc Científic de Barcelona
Baldiri Reixac 10, 08028 Barcelona, SPAIN
Tel. (+34) 9340 37155
http://www.irbbarcelona.org