3-D QSAutogrid/R: An Alternative Procedure To Build 3-D QSAR Models. Methodologies and Applications-Reference-Cited by-同舟云学术

3-D QSAutogrid/R: An Alternative Procedure To Build 3-D QSAR Models. Methodologies and Applications

Published:2012-06-13 Issue:6 Volume:52 Page:1674-1685
ISSN:1549-9596
Container-title:Journal of Chemical Information and Modeling
language:en
Short-container-title:J. Chem. Inf. Model.

Author:

Ballante Flavio¹,Ragno Rino¹

Affiliation:

1. Rome Center for Molecular Design, Dipartimento di Chimica e Tecnologie del Farmaco, Sapienza Università di Roma, P. le A. Moro 5, 00185, Rome, Italy

Publisher

American Chemical Society (ACS)

Subject

Library and Information Sciences,Computer Science Applications,General Chemical Engineering,General Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/ci300123x

Reference43 articles.

1. Open3DQSAR: a new open-source software aimed at high-throughput chemometric analysis of molecular interaction fields

2. Comparative molecular field analysis (CoMFA). 1. Effect of shape on binding of steroids to carrier proteins

3. A computational procedure for determining energetically favorable binding sites on biologically important macromolecules

4. Generating Optimal Linear PLS Estimations (GOLPE): An Advanced Chemometric Tool for Handling 3D-QSAR Problems

5. Comparative Molecular Field Analysis Using GRID Force-Field and GOLPE Variable Selection Methods in a Study of Inhibitors of Glycogen Phosphorylase b

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