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Parameterization of Noncovalent Interactions for Transition State Interrogation Applied to Asymmetric Catalysis
The use of computed interaction energies and distances as parameters in multivariate correlations is introduced for postulating noncovalent interactions. This new class of descriptors affords multivariate correlations for two diverse catalytic systems with unique noncovalent interactions at the hear...
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| Publicado no: | J Am Chem Soc |
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| Main Authors: | , , , , |
| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
2017
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| Assuntos: | |
| Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC5639935/ https://ncbi.nlm.nih.gov/pubmed/28475315 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/jacs.7b02311 |
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