[gmx-users] Umbrella Sampling

Mouri Ahmed mouriahmedmou at gmail.com
Sun Nov 13 11:10:17 CET 2016


Hi everyone,

I have run pulling simulation for the protein complex system. I have got
1000 configuration files. And in the summary_distances.dat, I have found
0-500 distances.

How will I select configuration file for the npt_umbrella simulation.

Thanks in advance. I will be very grateful for the help.

Best Regards
Mouri


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