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Combinatorial Explosion in Conformational Analysis

Conformational analysis is a combinatorial problem. The number of conformations for a molecule with n rotatable bonds is given by  [Pg.195]

To illustrate the number of conformers generated for a typical pharmaceutical like database, OMEGA calculations were carried out for the 450000 compounds [Pg.195]

See other pages where Combinatorial Explosion in Conformational Analysis is mentioned: [Pg.195]   


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