[gmx-users] Use of providing -ix pullx.xvg in WHAM

jay patil jpatil911 at gmail.com
Thu Aug 17 15:38:23 CEST 2017


Hello Experts,
What property we can calculate by providing -ix pullx.xvg through gmx WHAM command. Like -if pullf.xvg can give PMF. 

Is there way to calculate diffusivity using WHAM command or any other command.
Please suggest a way.

Thanks
Yogesh


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