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Chirality Codes and Molecular Structure
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What this work says
Outgoing claims: the papers this work cites, builds on, or argues with.
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Iterative partial equalization of orbital electronegativity—a rapid access to atomic charges
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Algebraic aspects of the chirality phenomenon in chemistry
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Novel Chirality Descriptors Derived from Molecular Topology
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Validation of DAPPER for 3D QSAR: Conformational Search and Chirality Metric
inferredcites →https://doi.org/10.1021/ci970460kopenalex-snapshot
Atomic Chirality, a Quantitative Measure of the Chirality of the Environment of an Atom
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From atoms and bonds to three-dimensional atomic coordinates: automatic model builders
inferredcites →https://doi.org/10.1021/ja00106a053openalex-snapshot
Continuous Symmetry Measures. 4. Chirality
inferredcites →https://doi.org/10.1021/jm0009134openalex-snapshot
Deriving a Quantitative Chirality Measure from Molecular Similarity Indices
What points at this work
Incoming claims: where this work appears in other papers’ reference lists and arguments.
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Calculation of Structure Descriptors
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Calculation of Structure Descriptors
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Methods of studies on quantitative structure–activity relationships for chiral compounds
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Chirality Codes and Molecular Structure.
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Data mining and enantiophore studies on chiral stationary phases used in HPLC separation
inferred← citeshttps://doi.org/10.1002/jcc.20964openalex-snapshot
Bond‐based 3D‐chiral linear indices: Theory and QSAR applications to central chirality codification
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Exploring enantioselective molecular recognition mechanisms with chemoinformatic techniques
inferred← citeshttps://doi.org/10.1002/qsar.200530001openalex-snapshot
Chirality Factors and Their Application to QSAR Studies of Chiral Molecules
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Encoding Absolute Configurations with Chiral Enantiophore Descriptors. Application to the Order of Elution of Enantiomers in Liquid Chromatography
inferred← citeshttps://doi.org/10.1002/qsar.200960085openalex-snapshot
Applications of Bond‐Based 3D‐Chiral Quadratic Indices in QSAR Studies Related to Central Chirality Codification
inferred← citeshttps://doi.org/10.1002/qua.26793openalex-snapshot
Control of chirality, bond flexing and anharmonicity in an electric field
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Chirality Descriptors for Numerical Characterization of Enantiomers and Diastereomers
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3D-chiral (2.5) atom-based TOMOCOMD-CARDD descriptors: theory and QSAR applications to central chirality codification
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Novel global and local 3D atom-based linear descriptors of the Minkowski distance matrix: theory, diversity–variability analysis and QSPR applications
inferred← citeshttps://doi.org/10.1007/s10910-023-01531-2openalex-snapshot
Chirality descriptors for structure–activity relationship modeling of bioactive molecules
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Molecular similarity and diversity in chemoinformatics: From theory to applications
inferred← citeshttps://doi.org/10.1007/s11030-008-9068-xopenalex-snapshot
Counter propagation artificial neural networks modeling of an enantioselectivity of artificial metalloenzymes
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When global and local molecular descriptors are more than the sum of its parts: Simple, But Not Simpler?
inferred← citeshttps://doi.org/10.1016/j.aca.2004.12.012openalex-snapshot
Prediction of enantioselectivity using chirality codes and Classification and Regression Trees
inferred← citeshttps://doi.org/10.1016/j.bmc.2013.04.044openalex-snapshot
Predicting CYP2C19 catalytic parameters for enantioselective oxidations using artificial neural networks and a chirality code
inferred← citeshttps://doi.org/10.1016/j.chroma.2009.07.002openalex-snapshot
Quantitative structure enantioselective retention relationship for high-performance liquid chromatography chiral separation of 1-phenylethanol derivatives
inferred← citeshttps://doi.org/10.1016/j.jmgm.2006.09.007openalex-snapshot
Atom-based stochastic and non-stochastic 3D-chiral bilinear indices and their applications to central chirality codification
inferred← citeshttps://doi.org/10.1016/j.jmgm.2010.08.007openalex-snapshot
Complementing ultrafast shape recognition with an optical isomerism descriptor
inferred← citeshttps://doi.org/10.1016/j.tet.2019.02.007openalex-snapshot
Evaluating continuous chirality measure as a 3D descriptor in chemoinformatics applied to asymmetric catalysis
inferred← citeshttps://doi.org/10.1016/j.xcrp.2025.103065openalex-snapshot
A unifying geometric framework for computational representation of stereoisomers based on mixed product
inferred← citeshttps://doi.org/10.1021/ci050400bopenalex-snapshot
The Blue Obelisk—Interoperability in Chemical Informatics
inferred← citeshttps://doi.org/10.1021/ci300057hopenalex-snapshot
Chirality Measures of α-Amino Acids
inferred← citeshttps://doi.org/10.1021/je300783eopenalex-snapshot
Enthalpies of Dilution of Penicillamines in N,N-Dimethylformamide + Water Mixtures at 298.15 K
inferred← citeshttps://doi.org/10.1201/9781420065442.ch31openalex-snapshot
Predicting Chemical Reactivity and Bioactivity of Molecules from Structure
inferred← citeshttps://doi.org/10.2174/1568026623666230731103309openalex-snapshot
Physicochemical Significance of Topological Indices: Importance in Drug Discovery Research
inferred← citeshttps://doi.org/10.2174/157340909787580836openalex-snapshot
Numerical Characterization of Molecular Chirality of Organic Compounds
inferred← citeshttps://doi.org/10.3390/molecules17089971openalex-snapshot
BCL::EMAS — Enantioselective Molecular Asymmetry Descriptor for 3D-QSAR
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