A comparative molecular surface analysis (COMSA). A new efficient technique for drug design.
Several applications of the COMSA were discussed including a series of the potential anti-HIV drugs and a series of dyes.
Polański
Jarosław
J
Institute of Chemistry, University of Silesia, Katowice.
Gieleciak
Rafał
R
Bak
Andrzej
A
Jarzembek
Krystyna
K
Wyszomirski
Mirosław
M
D000962:Antimalarials / Q000138:chemical synthesis / Q000737:chemistry; D015195:Drug Design; D019428:HIV Integrase Inhibitors / Q000138:chemical synthesis / Q000737:chemistry; D009682:Magnetic Resonance Spectroscopy / Q000379:methods*; D008958:Models, Molecular; D008968:Molecular Conformation; D016571:Neural Networks, Computer; D013329:Structure-Activity Relationship
D000962:Antimalarials; D019428:HIV Integrase Inhibitors