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A PLS QSAR analysis using 3D generated aromatic descriptors of principal property type: Application to some dopamine D2 benzamide antagonists

✍ Scribed by Ulf Norinder


Publisher
Springer Netherlands
Year
1993
Tongue
English
Weight
616 KB
Volume
7
Category
Article
ISSN
0920-654X

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✦ Synopsis


A simple and computationally nonintensive technique based on principal component analysis of 3D fields to derive theoretical descriptors is presented. The descriptors are then applied to a quantitative structureactivity relationship study on some dopamine D2 antagonists of benzamide type.