검색결과 : 2건
| No. | Article |
|---|---|
| 1 |
Use of a QM/MM-Based FEP Method to Evaluate the Anomalous Hydration Behavior of Simple Alkyl Amines and Amides: Application to the Design of FBPase Inhibitors for the Treatment of Type-2 Diabetes Reddy MR, Singh UC, Erion MD Journal of the American Chemical Society, 133(21), 8059, 2011 |
| 2 |
Development of a quantum mechanics-based free-energy perturbation method: Use in the calculation of relative solvation free energies Reddy MR, Singh UC, Erion MD Journal of the American Chemical Society, 126(20), 6224, 2004 |