Yaxiong X. Sun
Affiliations: | 1994 | Pharmaceutical Chemistry | University of California, San Francisco, San Francisco, CA |
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Publications
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| Sun Y, Kollman P. (1996) Are There Water-Bridge-Induced Hydrophilic Interactions? The Journal of Physical Chemistry. 100: 6760-6763 |
| Sun Y, Kollman PA. (1995) Quantitation and nature of the macrocyclic effect: K+ complexation with 18-crown-6 and pentaglyme Journal of the American Chemical Society. 117: 3599-3604 |
| Sun Y, Caldwell JW, Kollman PA. (1995) Molecular dynamics and free energy perturbation study of spherand complexation with metal ions employing additive and nonadditive force fields Journal of Physical Chemistry. 99: 10081-10085 |
| Sun Y, Kollman PA. (1995) Hydrophobic solvation of methane and nonbond parameters of the TIP3P water model Journal of Computational Chemistry. 16: 1164-1169 |
| Sun Y, Kollman PA. (1992) Determination of solvation free energy using molecular dynamics with solute Cartesian mapping: An application to the solvation of 18-crown-6 The Journal of Chemical Physics. 97: 5108-5112 |
| Sun Y, Spellmeyer D, Pearlman DA, et al. (1992) Simulation of the solvation free energies for methane, ethane, and propane and corresponding amino acid dipeptides : a critical test of the bond-PMF correction, a new set of hydrocarbon parameters, and the gas phase-water hydrophobicity scale Journal of the American Chemical Society. 114: 6798-6801 |
| Sun Y, Kollman PA. (1992) Conformational sampling and ensemble generation by molecular dynamics simulations: 18-Crown-6 as a test case Journal of Computational Chemistry. 13: 33-40 |