Estimation of Molecular Similarity Based on 4D-QSAR Analysis: Formalism and Validation
Author:
Affiliation:
1. Laboratory of Molecular Modeling and Design, Department of Medicinal Chemistry and Pharmacognosy M/C 781, College of Pharmacy, University of Illinois at Chicago, 833 South Wood Street, Chicago, Illinois 60612-7231
Publisher
American Chemical Society (ACS)
Subject
Computational Theory and Mathematics,Computer Science Applications,Information Systems,General Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/ci0100090
Reference27 articles.
1. Chemical Diversity Approach for Evaluating Mechanistic Relatedness Among Toxicological Phenomena
2. Quasi-orthogonal Basis Sets of Molecular Graph Descriptors as a Chemical Diversity Measure
3. Quantum Molecular Similarity. 1. BCP Space
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