L. Xu et Yy. Yao, STUDIES ON STRUCTURE-CARCINOGENIC ACTIVIT Y RELATIONSHIP OF N-NITROSOCOMPOUNDS, Gaodeng xuexiao huaxue xuebao, 16(9), 1995, pp. 1371-1373
The electronic parameters of 12 N-nitroso compounds have been computat
ed with semiempirical quantum chemical calculation, and the study on t
he relationships between the structures of these compounds and the car
cinogenic activities have been performed by using multivariate regress
ion analysis and neural network with satisfactory results.