GitHub - Nevensky/Free-Energy-Scripts: A set of scripts designed for batch creation of Gromacs inputs for Free Energy calculations (TI,BAR,MBAR,Umbrella sampling)). · GitHub

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Free-Energy-Scripts

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A set of scripts designed for batch creation of Gromacs inputs for Free Energy calculations (TI,BAR,MBAR,Umbrella sampling)).

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Name		Name	Last commit message	Last commit date
BAR/apsolutne		BAR/apsolutne
Umbrella Sampling		Umbrella Sampling
.gitignore		.gitignore
LICENSE.md		LICENSE.md
README.md		README.md

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FreeEnergySkripte

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A set of scripts designed for batch creation of Gromacs inputs for Free Energy calculations (TI,BAR,MBAR,Umbrella sampling)).

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