SSAGESproject / SSAGES

Software Suite for Advanced General Ensemble Simulations
GNU General Public License v3.0
81 stars 28 forks source link

How to get the free energy value for FFS method #42

Closed zheng001a closed 1 year ago

zheng001a commented 1 year ago

Dear SSAGES Developers,

I am a graduate student studying for a master's degree. I am using the FFS method in SSAGES software to study droplet wetting behavior on rough surfaces and would like to be able to get the free energy values during droplet wetting.

Please allow me to ask some question. Could you tell me how to output the free energy value for FFS method? Alternatively, is there any other method or software that can help me get the free energy value for the FFS method?

I would appreciate if you answer my question.

Sincerely yours, Zheng