METHODS iSpartan uses molecular mechanics based on the Merck Molecular Force Field (MMFF) for 2D→3D conversion and for conformational searching.1 Except for the heat of formation, quantum chemical results obtained eith

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Date: 2014-03-28 15:00:57 Molecular physics Nuclear magnetic resonance Spectroscopy Theoretical chemistry Computational chemistry Spartan Nuclear magnetic resonance spectroscopy Molecular orbital Force field Chemistry Science Physics		METHODS iSpartan uses molecular mechanics based on the Merck Molecular Force Field (MMFF) for 2D→3D conversion and for conformational searching.1 Except for the heat of formation, quantum chemical results obtained eith Add to Reading List Source URL: www.wavefun.com Download Document from Source Website File Size: 2,70 MB Share Document on Facebook

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