/tools/CaFE_Plugin

CaFE_Plugin

HuiLiuCode/CaFE_Plugin

28 stars13 forksTclAdded February 8, 2026
summary

CaFE is a VMD plugin that facilitates the prediction of binding affinities through the calculation of free energy. It employs end-point free energy methods, making it a valuable tool for researchers in molecular modeling and drug discovery.

description

a VMD plugin for binding affinity prediction using end-point free energy methods

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