Journal ArticleDOI
Molecular Mapping and Docking Interactions for Selective Anti-Fertility Potency of Estrogen Analogs
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This article is published in Letters in Drug Design & Discovery.The article was published on 2011-11-30. It has received 0 citations till now. The article focuses on the topics: Docking (molecular) & Estrogen analog.read more
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Journal ArticleDOI
Cloning of a novel receptor expressed in rat prostate and ovary.
TL;DR: It is concluded that clone 29 cDNA encodes a novel rat ER, which is suggested be named rat ERbeta to distinguish it from the previously cloned ER (ERalpha) from rat uterus.
Journal ArticleDOI
Comparative molecular field analysis (CoMFA). 1. Effect of shape on binding of steroids to carrier proteins.
TL;DR: The main features of the CoMFA approach, exemplified by analyses of the affinities of 21 varied steroids to corticosteroid and testosterone-binding globulins, and a number of advances in the methodology of molecular graphics are described.
Journal ArticleDOI
PLS regression methods
TL;DR: In this paper, the mathematical and statistical structure of PLS regression is developed and the PLS decomposition of the data matrices involved in model building is analyzed. But the PLP regression algorithm can be interpreted in a model building setting.
Journal ArticleDOI
Molecular similarity indices in a comparative analysis (CoMSIA) of drug molecules to correlate and predict their biological activity.
TL;DR: An alternative approach is reported to compute property fields based on similarity indices of drug molecules that have been brought into a common alignment using a Gaussian-type distance dependence, and no singularities occur at the atomic positions.
Journal ArticleDOI
Molecular Recognition and Docking Algorithms
TL;DR: This review focuses on methodological developments relevant to the field of molecular docking, and summarizes several critical methodological issues that must be addressed in future developments.
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