Testing inhomogeneous solvation theory in structure-based ligand discovery

Autor: Balius, Trent E., Fischer, Marcus, Stein, Reed M., Adler, Thomas B., Nguyen, Crystal N., Cruz, Anthony, Gilson, Michael K., Kurtzman, Tom, Shoichet, Brian K.
Zdroj: Proceedings of the National Academy of Sciences of the United States of America, 2017 Aug . 114(33), E6839-E6846.
Databáze: JSTOR Journals