A model of atomic compressibility and its application in QSAR domain for toxicological property prediction

Title
A model of atomic compressibility and its application in QSAR domain for toxicological property prediction
Authors
Keywords
Conceptual density functional theory (CDFT), Periodicity, Group compressibility, Polarizability, Quantitative structure–activity relationship (QSAR), Toxicity
Journal
JOURNAL OF MOLECULAR MODELING
Volume 25, Issue 10, Pages -
Publisher
Springer Science and Business Media LLC
Online
2019-09-06
DOI
10.1007/s00894-019-4199-9

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