BiophysicsbioRxiv
The Rosetta all-atom energy function for macromolecular modeling and design
R. F. Alford, A. Leaver-Fay, J. R. Jeliazkov…·J. J. Gray
The paper explains the Rosetta all-atom energy function, its mathematical models, and its application to biomolecular modeling and design, including new capabilities for membrane proteins and other macromolecules.
DOI 10.1021/acs.jctc.7b00125