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Modeling Properties with Higher-Level Molecular Connectivity Descriptors
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What this work says
Outgoing claims: the papers this work cites, builds on, or argues with.
inferredcites →https://doi.org/10.1002/anie.198608821openalex-snapshot
Geometric and Topological Thinking in Organic Chemistry
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Molecular Connectivity II: Relationship to Water Solubility and Boiling Point
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Size Distribution Effects in Multiparticulate Dissolution
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Analysis of Drug Contamination from Parabens in Theophylline Olamine
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Modeling the solubility and activity of amino acids with the LCCI method
inferredcites →https://doi.org/10.1007/bf01007288openalex-snapshot
Pariser-parr-pople calculations on different DNA constituents
inferredcites →https://doi.org/10.1007/bf01200826openalex-snapshot
Predicting properties of molecules using graph invariants
inferredcites →https://doi.org/10.1016/0097-8485(93)80008-2openalex-snapshot
Molecular connectivity model for determination of T1 relaxation times of α-carbons of amino acids and cyclic dipeptides
inferredcites →https://doi.org/10.1016/0160-9327(86)90116-xopenalex-snapshot
Molecular connectivity in structure-activity analysis
inferredcites →https://doi.org/10.1016/0166-218x(88)90004-2openalex-snapshot
Determining structural similarity of chemicals using graph-theoretic indices
inferredcites →https://doi.org/10.1021/ci00002a018openalex-snapshot
Resolution of ambiguities in structure-property studies by use of orthogonal descriptors
inferredcites →https://doi.org/10.1021/ci00002a019openalex-snapshot
The Beilstein Structure Registry System. 1. General design
inferredcites →https://doi.org/10.1021/ci00005a014openalex-snapshot
Wiener and Randic topological indexes for graphs
inferredcites →https://doi.org/10.1021/ci00005a015openalex-snapshot
Domain-oriented knowledge-acquisition tool for protein purification planning
inferredcites →https://doi.org/10.1021/ci00058a005openalex-snapshot
End-user searching of CAS ONLINE. Results of a cooperative experiment between Imperial Chemical Industries and Chemical Abstracts Service
inferredcites →https://doi.org/10.1021/ci960020dopenalex-snapshot
Modeling Purines and Pyrimidines with the Linear Combination of Connectivity Indices−Molecular Connectivity “LCCI-MC” Method
inferredcites →https://doi.org/10.1021/ed064p575openalex-snapshot
Molecular structure: Property relationships
inferredcites →https://doi.org/10.1021/ed065p580openalex-snapshot
Novel models for illustrating chirality at two centers
inferredcites →https://doi.org/10.1021/ed069p701openalex-snapshot
A graph-theoretical approach to structure-property relationships
inferredcites →https://doi.org/10.1021/j100003a015openalex-snapshot
Molecular Modeling by Linear Combinations of Connectivity Indexes
inferredcites →https://doi.org/10.1021/j100056a021openalex-snapshot
Molecular connectivity descriptors of the physicochemical properties of the .alpha.-amino acids
inferredcites →https://doi.org/10.1021/j100127a026openalex-snapshot
Molecular connectivity model for determination of physicochemical properties of .alpha.-amino acids
inferredcites →https://doi.org/10.1021/ja00221a015openalex-snapshot
Molecular modeling of the physical properties of alkanes
inferredcites →https://doi.org/10.1021/ja00856a001openalex-snapshot
Characterization of molecular branching
inferredcites →https://doi.org/10.1021/ja00856a002openalex-snapshot
Importance of nonbonded attraction in the stereochemistry of the SN2' reaction
inferredcites →https://doi.org/10.1021/jp961434copenalex-snapshot
Modeling with Special Descriptors Derived from a Medium-Sized Set of Connectivity Indices
inferredcites →https://doi.org/10.1080/05704928408081715openalex-snapshot
Studies of Hydration by Broad-Line Pulsed NMR
inferredcites →https://doi.org/10.1080/10629369408233985openalex-snapshot
Molecular Similarity and Risk Assessment: Analog Selection and Property Estimation Using Graph Invariants
inferredcites →https://doi.org/10.1246/bcsj.71.191openalex-snapshot
Optimization of a Regression Model for a Quantitative Structure. Mutagenicity Relationship of Some Natural Amino Acids
What points at this work
Incoming claims: where this work appears in other papers’ reference lists and arguments.
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Applications of Flexible Molecular Descriptors in the QSPR–QSAR Study of Heterocyclic Drugs
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Estimating the higher-order Randić index
inferred← citeshttps://doi.org/10.1021/ci000106dopenalex-snapshot
Retro-RegressionAnother Important Multivariate Regression Improvement
inferred← citeshttps://doi.org/10.1021/ci0003092openalex-snapshot
A Novel PI Index and Its Applications to QSPR/QSAR Studies
inferred← citeshttps://doi.org/10.1021/cr0004456openalex-snapshot
From Molecular Connectivity Indices to Semiempirical Connectivity Terms: Recent Trends in Graph Theoretical Descriptors
inferred← citeshttps://doi.org/10.1021/jp001191vopenalex-snapshot
Modeling with Molecular Pseudoconnectivity Descriptors. A Useful Extension of the Intrinsic I-State Concept
inferred← citeshttps://doi.org/10.1021/jp983268+openalex-snapshot
Modeling with Semiempirical Molecular Connectivity Terms
inferred← citeshttps://doi.org/10.1080/10629360802551000openalex-snapshot
Improvement of charge-transfer indices for multifunctional amino acids: Application to lysozyme
inferred← citeshttps://doi.org/10.1109/bibmw.2010.5703782openalex-snapshot
Computing the connectivity indices of α- and β-cyclodextrins
inferred← citeshttps://doi.org/10.3797/scipharm.0804-12openalex-snapshot
Chemical Structure Indices in In Silico Molecular Design
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