Applications of frontier molecular orbital energies in QSAR studies.
Huang
Q
Q
Department of Environmental Science and Engineering, Nanjing University, People's Republic of China.
Kong
L
L
Wang
L
L
D000814:Aniline Compounds / Q000737:chemistry / Q000633:toxicity*; D000818:Animals; D001555:Benzene Derivatives / Q000737:chemistry / Q000633:toxicity*; D002273:Carcinogens / Q000737:chemistry / Q000633:toxicity*; D003530:Cyprinidae; D008163:Luminescent Measurements; D008956:Models, Chemical; D010636:Phenols / Q000737:chemistry / Q000633:toxicity*; D010776:Photobacterium / Q000187:drug effects; D011789:Quantum Theory; D012016:Reference Values; D012044:Regression Analysis; D013045:Species Specificity; D013329:Structure-Activity Relationship
D000814:Aniline Compounds; D001555:Benzene Derivatives; D002273:Carcinogens; D010636:Phenols