BiophysicsbioRxivPreprint
Collinearity of Decomposed Energy Terms in MM-P(G)BSA Binding Free Energy Calculations of Protein-Protein Complexes
This paper evaluates MM-P(G)BSA methods for protein-protein complexes, revealing collinearity among energy terms and poor RBFE accuracy, suggesting the need for combining correlated terms.
DOI 10.64898/2026.06.24.734195