[gmx-users] free energy calculation
elham.tazikeh at gmail.com
Thu Oct 16 11:02:45 CEST 2014
For calculating free energy of methan (in justin tutorial)
I changed important parameters instead of the parameters in lambda=0 that
having in that tutorial
Is it correct?
Or i must create those files by this command:
Perl write_mdp.pl em_steep.mdp for every lambda?!
I did this way.but my received files were empty
Please help me
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