1026846-54-7Relevant articles and documents
Quantitative structure-activity relationship modeling of dopamine D1 antagonists using comparative molecular field analysis, genetic algorithms- partial least-squares, and K nearest neighbor methods
Hoffman, Brian,Cho, Sung Jin,Zheng, Weifan,Wyrick, Steven,Nichols, David E.,Mailman, Richard B.,Tropsha, Alexander
, p. 3217 - 3226 (2007/10/03)
Several quantitative structure-activity relationship (QSAR) methods were applied to 29 chemically diverse D1 dopamine antagonists. In addition to conventional 3D comparative molecular field analysis (CoMFA), cross-validated R2 guided