Improved side-chain torsion potentials for the Amber ff99SB protein force field

por Lindorff-Larsen, Kresten, Piana, Stefano, Palmo, Kim, Maragakis, Paul, Klepeis, John L, Dror, Ron O, Shaw, David E
Publicado 2010

Handbook of test problems in local and global optimization

por Floudas, Christodoulos A, Pardalos, Pãnos M, Adjiman, Claire S, Esposito, William R, Gümüş, Zeynep H, Harding, Stephen T, Klepeis, John L, Meyer, Clifford A, Schweiger, Carl A
Publicado 1999

Quantum chemical benchmark databases of gold-standard dimer interaction energies

por Donchev, Alexander G., Taube, Andrew G., Decolvenaere, Elizabeth, Hargus, Cory, McGibbon, Robert T., Law, Ka-Hei, Gregersen, Brent A., Li, Je-Luen, Palmo, Kim, Siva, Karthik, Bergdorf, Michael, Klepeis, John L., Shaw, David E.
Publicado 2021