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QSPR modeling of the half-wave potentials of benzoxazines by optimal descriptors calculated with the SMILES

Paper ID Volume ID Publish Year Pages File Format Full-Text
15402 1410 2006 4 PDF Available
Title
QSPR modeling of the half-wave potentials of benzoxazines by optimal descriptors calculated with the SMILES
Abstract

Optimal descriptors calculated with Simplified Molecular Input Line Entry System (SMILES) notation have been used in quantitative structure–property relationships (QSPR) modeling electrochemical half-wave potential of benzoxazine derivatives by one-variable correlations.

Keywords
QSPR; SMILES; Optimal descriptor; Half-wave potential of benzoxazines
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QSPR modeling of the half-wave potentials of benzoxazines by optimal descriptors calculated with the SMILES
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Publisher
Database: Elsevier - ScienceDirect
Journal: Computational Biology and Chemistry - Volume 30, Issue 6, December 2006, Pages 434–437
Authors
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Subjects
Physical Sciences and Engineering Chemical Engineering Bioengineering
Get Full-Text Now
Don't Miss Today's Special Offer
Price was $35.95
You save - $31
Price after discount Only $4.95
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Full-text PDF Download
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