Journal of Physical Chemistry B 2005 Arieh Warshel - Abstracts
| Journal of Physical Chemistry B 2005 Arieh Warshel | |||||
| Title | Subject | Authors | |||
|---|---|---|---|---|---|
| On possible pitfalls in ab initio quantum mechanics/molecular mechanics minimization approaches for studies of enzymatic reactions. | Chemicals, plastics and rubber industries | Arieh Warshel, Sonja Braun-Sand, Marco Klahn, Edina Rosta | |||
| Realistic simulations of proton transport along the gramicidin channel: Demonstrating the importance of solvation effects. | Chemicals, plastics and rubber industries | Arieh Warshel, Sonja Braun-Sand, Anton Burykin, Zhen Tao Chu | |||
| Through the channel and around the channel: Validating and comparing microscopic approaches for the evaluation of free energy profiles for ion penetration through ion channels. | Chemicals, plastics and rubber industries | Arieh Warshel, Mitsunori Kato | |||
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