BioEFP - extending EFP to proteins

BioEFP is a scheme to split a macromolecule into fragments. Proteins can be split along C-Ca bonds, as shown below.

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The model is described here.

Check out our tools and tutorials on how to

prepare a protein system for EFP protein-ligand calculations
prepare a protein system for QM/EFP calculations QM/EFP calculations using BioEFP and FlexEFP