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Modeling Multiple Species of Nicotine and Deschloroepibatidine Interacting with α4β2 Nicotinic Acetylcholine Receptor: From Microscopic Binding to Phenomenological Binding Affinity
A variety of molecular modeling, molecular docking, and first-principles electronic structure calculations were performed to study how the α4β2 nicotinic acetylcholine receptor (nAChR) binds with different species of two typical agonists, S-(−)-nicotine and R-(−)-deschloroepibatidine, each of which...
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| Hauptverfasser: | , , , , |
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| Format: | Artigo |
| Sprache: | Inglês |
| Veröffentlicht: |
2005
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| Schlagworte: | |
| Online Zugang: | https://ncbi.nlm.nih.gov/pmc/articles/PMC3182463/ https://ncbi.nlm.nih.gov/pubmed/16218635 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/ja052681+ |
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