| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 7772222 | Bioorganic Chemistry | 2012 | 9 Pages |
Abstract
⺠The geometries of the stationary points in water solution were optimized. ⺠The P-path is accessible for HPpNP, but for s-2â²pNP the C-path is favorable. ⺠The calculated energy barriers are in agreement with the experimental results.
Keywords
Related Topics
Physical Sciences and Engineering
Chemistry
Organic Chemistry
Authors
Futing Xia, Hua Zhu,