3D-chiral (2.5) atom-based TOMOCOMD-CARDD descriptors: theory and QSAR applications to central chirality codification

DOI10.1007/S10910-008-9386-3zbMath1217.92094OpenAlexW2041490868WikidataQ56985143 ScholiaQ56985143MaRDI QIDQ552021

Juan Alberto Castillo-Garit, Yovani Marrero-Ponce, Eduardo A. Castro, Richard Rotondo, Francisco Torrens

Publication date: 21 July 2011

Published in: Journal of Mathematical Chemistry (Search for Journal in Brave)

Full work available at URL: https://doi.org/10.1007/s10910-008-9386-3

zbMATH Keywords

\(\sigma \)-receptor antagonists 3D-QSAR angiotesin-converting enzyme inhibitors binding affinity of steroids non-stochastic and stochastic 3D-chiral (2.5) atom-based \texttt{TOMOCOMD-CARDD} descriptors

Mathematics Subject Classification ID

Molecular structure (graph-theoretic methods, methods of differential topology, etc.) (92E10)

Related Items (4)

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