The mechanism of molecular activation
β Scribed by Norrish, R. G. W.
- Publisher
- Wiley (John Wiley & Sons)
- Year
- 1924
- Weight
- 258 KB
- Volume
- 43
- Category
- Article
- ISSN
- 0368-4075
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π SIMILAR VOLUMES
Conformational analysis of 20 neolignans was performed to determine the most probable conformer that may fit the receptor. The molecular Ε½ . mechanics method MM2 was employed to construct conformational maps in both a vacuum and a biological environment. Boltzmann's distribution among several local
## Abstract We have run several molecular dynamics (MD) simulations on zincβcontaining phosphotriesterase (PTE) with two bound substrates, sarin and paraoxon, and with the substrate analog diethyl 4βmethylbenzylphosphonate. A standard nonbonded model was employed to treat the zinc ions with the com