A Simple QM/MM Approach for Capturing Polarization Effects in Protein-Ligand Binding Free Energy Calculations

Frank R. Beierlein, Julien Michel, Jonathan W. Essex

Research output: Contribution to journalArticlepeer-review

Fingerprint

Dive into the research topics of 'A Simple QM/MM Approach for Capturing Polarization Effects in Protein-Ligand Binding Free Energy Calculations'. Together they form a unique fingerprint.

Chemistry