Dear all,
I was surprised that my Google search for Replica Exchange for Umbrella
sampling using Gromacs did not yield a positive result.
Is it really not possible to perform HRE for US within the framework of
Gromacs?
Thanks in advance for any answer, hint, or tutorial!
All the best
Johannes
--
______________________________________
*Technische Universität München*
*Johannes Hermann, M.Sc.*
Lehrstuhl für Bioverfahrenstechnik
Boltzmannstr. 15
D-85748 Garching
Tel: +49 8928915730
Fax: +49 8928915714
Email: j.herm...@lrz.tum.de
http://www.biovt.mw.tum.de/
--
Gromacs Users mailing list
* Please search the archive at
http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before posting!
* Can't post? Read http://www.gromacs.org/Support/Mailing_Lists
* For (un)subscribe requests visit
https://maillist.sys.kth.se/mailman/listinfo/gromacs.org_gmx-users or send a
mail to gmx-users-requ...@gromacs.org.
