Novel 2D TOMOCOMD-CARDD molecular descriptors: atom-based stochastic and non-stochastic bilinear indices and their QSPR applications
DOI10.1007/S10910-008-9389-0zbMATH Open1217.92095OpenAlexW2068068200WikidataQ56985164 ScholiaQ56985164MaRDI QIDQ552009FDOQ552009
Authors: Yovani Marrero-Ponce, Francisco Torrens, Ramón García-Domenech, Sadiel E. Ortega-Broche, Vicente Romero Zaldivar 
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/s10910-008-9389-0
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genetic algorithm\texttt{TOMOCOMD-CARDD} softwarenon-stochastic and stochastic atom-based bilinear indicesoctane isomersphysicochemical propertiesQSPR model
Computing methodologies and applications (68U99) Applications of statistics to physics (62P35) Molecular structure (graph-theoretic methods, methods of differential topology, etc.) (92E10)
Cites Work
Cited In (8)
- Simple stochastic fingerprints towards mathematical modelling in biology and medicine. I: The treatment of coccidiosis
- LEGO-based generalized set of two linear algebraic 3D bio-macro-molecular descriptors: theory and validation by QSARs
- 3D-chiral (2.5) atom-based TOMOCOMD-CARDD descriptors: theory and QSAR applications to central chirality codification
- Nucleotide's bilinear indices: novel bio-macromolecular descriptors for bioinformatics studies of nucleic acids. I: Prediction of paromomycin's affinity constant with HIV-1 \(\Psi\)-RNA packaging region
- Novel global and local 3D atom-based linear descriptors of the Minkowski distance matrix: theory, diversity-variability analysis and QSPR applications
- New spectral indices for molecule description
- Novel atom-type-based topological descriptors for simultaneous prediction of gas chromatographic retention indices of saturated alcohols on different stationary phases
- DRAGON software: an easy approach to molecular descriptor calculations
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