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QSAR Study of Steroid Benchmark and Dipeptides Based on MEDV-13

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What this work says

Outgoing claims: the papers this work cites, builds on, or argues with.

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Predictive ability of regression models. Part II: Selection of the best predictive PLS model
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The application of molecular similarity calculations
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Determination of receptor-bound drug conformations by QSAR using flexible fitting to derive a molecular similarity index
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Evaluation of Quantitative Structure−Activity Relationship Methods for Large-Scale Prediction of Chemicals Binding to the Estrogen Receptor
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MS-WHIM Scores for Amino Acids: A New 3D-Description for Peptide QSAR and QSPR Studies
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Structurally Diverse Quantitative Structure−Property Relationship Correlations of Technologically Relevant Physical Properties
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3D-QSAR of angiotensin-converting enzyme and thermolysin inhibitors: a comparison of CoMFA models based on deduced and experimentally determined active site geometries
inferredcites →https://doi.org/10.1021/ja00226a005openalex-snapshot
Comparative molecular field analysis (CoMFA). 1. Effect of shape on binding of steroids to carrier proteins
inferredcites →https://doi.org/10.1021/jm00004a009openalex-snapshot
Molecular Similarity Matrixes and Quantitative Structure-Activity Relationships: A Case Study with Methodological Implications
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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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On the prediction of binding properties of drug molecules by comparative molecular field analysis
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Comparative molecular field analysis of in vitro growth inhibition of L1210 and HCT-8 cells by some pyrazoloacridines
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A computational procedure for determining energetically favorable binding sites on biologically important macromolecules
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Comparative computer graphics and solution studies of the DNA interaction of substituted anthraquinones based on doxorubicin and mitoxantrone
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Self-Organizing Molecular Field Analysis: A Tool for Structure−Activity Studies
inferredcites →https://doi.org/10.1023/a:1008048822117openalex-snapshot
QSAR modeling with the electrotopological state indices: Corticosteroids
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MS-WHIM, new 3D theoretical descriptors derived from molecular surface properties: A comparative 3D QSAR study in a series of steroids
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Application of the Electrotopological State Index to QSAR Analysis of Flavone Derivatives as HIV-1 Integrase Inhibitors

What points at this work

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ChemInform Abstract: QSAR Study of Steroid Benchmark and Dipeptides Based on MEDV‐13.
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Virtual Exploration of the Chemical Universe up to 11 Atoms of C, N, O, F: Assembly of 26.4 Million Structures (110.9 Million Stereoisomers) and Analysis for New Ring Systems, Stereochemistry, Physicochemical Properties, Compound Classes, and Drug Discovery
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Enhancement of Ordinal CoMFA by Ridge Logistic Partial Least Squares
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Quantitative Structure-Activity Relationship of Insecticidal Activity of Benzyl Ether Diamidine Derivatives
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