| Journal of Physical Chemistry B 2005 Darrin M. York |
| Title | Subject | Authors |
|---|
| Density functional study of the in-line mechanism of methanolysis of cyclic phosphate and thiophosphate esters in solution: Insight into thio effects in RNA transesterification. | Chemicals, plastics and rubber industries | Yun Liu, Darrin M. York, Brent A. Gregersen, Xabier Lopez |
| Smooth solvation method for d-orbital semiempirical calculations of biological reactions. 1. Implementation. | Chemicals, plastics and rubber industries | Walter Thiel, Darrin M. York, Jana Khandogin, Brent A. Gregersen |
| Smooth solvation method for d-orbital semiempirical calculations of biological reactions. 2. Application to transphosphorylation thio effects in solution. | Chemicals, plastics and rubber industries | Walter Thiel, Darrin M. York, Jana Khandogin, Brent A. Gregersen |
| Theoretical studies of dissociative phosporyl transfer in interconversion of phosphoenolpyruvate to phosphonopyruvate: Solvent effects, thio effects, and implications for enzymatic reactions. | Chemicals, plastics and rubber industries | Yun Liu, Darrin M. York, Dingguo Xu, Hua Guo |
| Variational electrostatic projection (VEP) methods for different modeling of the macromolecular electrostatic and solvation environment in activated dynamics simulations. | Chemicals, plastics and rubber industries | Brent A. Gregerson, Darrin M. York |
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