Browse by Author Parks, JM
|
|
|
|
|
| Title | Author(s) | Year | View Count |
 | Mechanism of cdc25b phosphatase with the small molecule substrate p-nitrophenyl phosphate from QM/MM-MFEP calculations | Parks, JM; Hu, H; Rudolph, J; Yang, W | 2009 | 57 |
| Quantum mechanics/molecular mechanics minimum free-energy path for accurate reaction energetics in solution and enzymes: Sequential sampling and optimization on the potential of mean force surface | Hu, H; Lu, Z; Parks, JM; Burger, SK; Yang, W | 2008 | 57 |
| Hepatitis C virus NS5B polymerase: QM/MM calculations show the important role of the internal energy in ligand binding | Parks, JM; Kondru, RK; Hu, H; Beratan, DN; Yang, W | 2008 | 65 |
| A pseudobond parametrization for improved electrostatics in quantum mechanical/molecular mechanical simulations of enzymes | Parks, JM; Hu, H; Cohen, AJ; Yang, W | 2008 | 44 |
|
|
|
|
