QSPR modeling of the half-wave potentials of benzoxazines by optimal descriptors calculated with the SMILES
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Publication:884277
DOI10.1016/j.compbiolchem.2006.09.003zbMath1118.92072OpenAlexW2072497704WikidataQ47873171 ScholiaQ47873171MaRDI QIDQ884277
Karel Palat, Andrey A. Toropov, Karel Waisser, Ivan jun. Raska, Karel Nesmerak
Publication date: 13 June 2007
Published in: Computational Biology and Chemistry (Search for Journal in Brave)
Full work available at URL: https://doi.org/10.1016/j.compbiolchem.2006.09.003
Chemistry (92E99) Biochemistry, molecular biology (92C40) Molecular structure (graph-theoretic methods, methods of differential topology, etc.) (92E10)
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