Application of COSMO-SAC to Solid Solubility in Pure and Mixed Solvent Mixtures for Organic Pharmacological Compounds
<p>In this work, we present two open literature databases, the VT-2005 Sigma Profile Database and the VT-2006 Solute Sigma Profile Database, that contain sigma profiles for 1,645 unique compounds. A sigma profile is a molecular-specific distribution of the surface-charge density, which enable...
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Virginia Tech
2014
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| Online Access: | http://hdl.handle.net/10919/31086 http://scholar.lib.vt.edu/theses/available/etd-01312007-123029/ |