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Found 1 dataset matching "conformational-energies".

Federal
Calculated conformer energies for organic molecules with multiple polar functionalities are method dependent: Taxol (case study)
- Organization: U.S. Department of Health & Human Services
- Updated: 2025-09-06
Background Molecular mechanics (MM) and quantum chemical (QM) calculations are widely applied and powerful tools for the stereochemical and conformational investigations of molecules....
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Search relevance: 146.35 | Views last month: 0

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Calculated conformer energies for organic molecules with multiple polar functionalities are method dependent: Taxol (case study)