title: Extended correlation of a bond reactivity index with carcinogenicity and metabolism of polycyclic hydrocarbons: a molecular orbital theory.
mesh_terms: D000818:Animals; D002273:Carcinogens; D055598:Chemical Phenomena; D002621:Chemistry; D008968:Molecular Conformation; D011083:Polycyclic Compounds / Q000378:metabolism / Q000633:toxicity*; D013329:Structure-Activity Relationship
chemical_list: D002273:Carcinogens; D011083:Polycyclic Compounds