[gmx-users] Different force constants for different umbrella windows?

Andreas Mecklenfeld a.mecklenfeld at tu-braunschweig.de
Tue Mar 31 09:08:01 CEST 2020


Dear GROMACS users,

I've a question regarding umbrella sampling and its evaluation with gmx 
wham. Is it possible to use different force constants for different 
umbrella windows?

Thanks,
Andreas


-- 
M. Sc. Andreas Mecklenfeld
Technische Universität Braunschweig
Institut für Thermodynamik
Hans-Sommer-Straße 5
38106 Braunschweig
Deutschland / Germany

Tel: +49 (0)531 391-2634
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https://www.tu-braunschweig.de/ift
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