[gmx-users] error in g_wham

Arunima Shilpi writetoash28 at gmail.com
Fri Feb 7 12:18:13 CET 2014


Hello sir,

I followed the tutorial for umbrella_sampling to calculate Potential Mean
Force (PMF) between the protein and ligand.

While I followed the comand

g_wham -it tpr-files.dat -if pullf-files.dat -o -hist -unit kCal


It shows the error as Segmentation fault (core dumped)

I request you to kindly guide to debug the error.


Regards


Arunima


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