검색결과 : 4건
| No. | Article |
|---|---|
| 1 |
Quantum molecular dynamics simulations regarding the dechlorination of trichloro ethene in the interlayer space of the 2 : 1 clay mineral nontronite Teppen BJ, Yu CH, Newton SQ, Miller DM, Schafer L Journal of Physical Chemistry A, 106(22), 5498, 2002 |
| 2 |
Predictions of Protein Backbone Structural Parameters from First Principles - Systematic Comparisons of Calculated N-C(Alpha)-C’ Angles with High-Resolution Protein Crystallographic Results Jiang XQ, Cao M, Teppen B, Newton SQ, Schafer L Journal of Physical Chemistry, 99(26), 10521, 1995 |
| 3 |
Choice of Computational Techniques and Molecular-Models for Ab-Initio Calculations Pertaining to Solid Silicates Teppen BJ, Miller DM, Newton SQ, Schafer L Journal of Physical Chemistry, 98(48), 12545, 1994 |
| 4 |
Ab-Initio Mia and Molecular Mechanics Studies of the Distorted Sucrose Linkage of Raffinose Vanalsenoy C, French AD, Cao M, Newton SQ, Schafer L Journal of the American Chemical Society, 116(21), 9590, 1994 |