| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 5380400 | Chemical Physics Letters | 2015 | 6 Pages |
Abstract
- Performing a detailed analysis of the HCV NS3/NS4A protease reaction mechanism.
- Higher level ab initio correction of the AM1/MM PES has been applied.
- Cleavage efficiency interpreted by the tetrahedral intermediate formation barrier.
- The possibility of a concerted reaction mechanism is opened (mainly for NS5A/5B).
Related Topics
Physical Sciences and Engineering
Chemistry
Physical and Theoretical Chemistry
Authors
José Ángel MartÃnez-González, Alex RodrÃguez, MarÃa Pilar Puyuelo, Miguel González, Rodrigo MartÃnez,