title: Nonlinear dependence in comparative molecular field analysis.
abstract: The applicability of the comparative molecular field analysis (CoMFA) approach to describe the nonlinear dependence of biological activity on lipophilicity in 3D quantitative structure-activity relationships (QSAR) has been demonstrated. The results indicate that the CoMFA approach is appropriate for describing nonlinear effects in 3D QSAR studies.
authors: Pharmaceutical Products Division, Abbott Laboratories, Abbott Park, IL 60064.
authors: K H
authors: KH
authors: Kim
mesh_terms: D001419:Bacteria / Q000187:drug effects; D001548:Benzalkonium Compounds / Q000737:chemistry / Q000494:pharmacology; D015195:Drug Design; D008958:Models, Molecular; D015394:Molecular Structure; D013329:Structure-Activity Relationship; D013816:Thermodynamics
chemical_list: D001548:Benzalkonium Compounds