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Descriptors, Physical Properties, and Drug-Likeness
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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/(sici)1096-987x(19970430)18:6<744::aid-jcc2>3.0.co;2-sopenalex-snapshot
VESPA: A new, fast approach to electrostatic potential-derived atomic charges from semiempirical methods
inferredcites →https://doi.org/10.1002/(sici)1097-461x(1999)75:1<17::aid-qua3>3.0.co;2-ropenalex-snapshot
Accurate parametrized variational calculations of the molecular electronic polarizability by NDDO-based methods
inferredcites →https://doi.org/10.1002/(sici)1097-461x(2000)77:1<473::aid-qua47>3.0.co;2-4openalex-snapshot
Additive NDDO-based atomic polarizability model
inferredcites →https://doi.org/10.1002/jcc.540100208openalex-snapshot
Optimization of parameters for semiempirical methods I. Method
inferredcites →https://doi.org/10.1002/jcc.540100209openalex-snapshot
Optimization of parameters for semiempirical methods II. Applications
inferredcites →https://doi.org/10.1002/jcc.540140502openalex-snapshot
Multicenter point charge model for high‐quality molecular electrostatic potentials from AM1 calculations
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The natural atomic orbital point charge model for PM3: Multipole moments and molecular electrostatic potentials
inferredcites →https://doi.org/10.1002/jcc.540151009openalex-snapshot
GEPOL: An improved description of molecular surfaces. III. A new algorithm for the computation of a solvent‐excluding surface
inferredcites →https://doi.org/10.1007/978-1-4757-1904-8openalex-snapshot
Principal Component Analysis
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Recursive Partitioning in the Health Sciences
inferredcites →https://doi.org/10.1007/978-3-642-88163-3openalex-snapshot
Self-Organization and Associative Memory
inferredcites →https://doi.org/10.1007/bf00527479openalex-snapshot
Calcul th�orique des polarisabilit�s �lectroniques mol�culaires. Comparaison des diff�rentes m�thodes
inferredcites →https://doi.org/10.1007/bf02289162openalex-snapshot
Some Necessary Conditions for Common-Factor Analysis
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Prediction of the n-Octanol/Water Partition Coefficient, logP, Using a Combination of Semiempirical MO-Calculations and a Neural Network
inferredcites →https://doi.org/10.1016/s0166-1280(97)00162-0openalex-snapshot
Statistical analysis of the molecular surface electrostatic potential: an approach to describing noncovalent interactions in condensed phases
inferredcites →https://doi.org/10.1016/s0169-409x(00)00129-0openalex-snapshot
Experimental and computational approaches to estimate solubility and permeability in drug discovery and development settings 1PII of original article: S0169-409X(96)00423-1. The article was originally published in Advanced Drug Delivery Reviews 23 (1997) 3–25. 1
inferredcites →https://doi.org/10.1016/s0169-409x(96)00423-1openalex-snapshot
Experimental and computational approaches to estimate solubility and permeability in drug discovery and development settings
inferredcites →https://doi.org/10.1021/cc0000388openalex-snapshot
Chemography: The Art of Navigating in Chemical Space
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A Quantum Mechanical/Neural Net Model for Boiling Points with Error Estimation
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A Temperature-Dependent Quantum Mechanical/Neural Net Model for Vapor Pressure
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Enhanced 3D-Databases: A Fully Electrostatic Database of AM1-Optimized Structures
inferredcites →https://doi.org/10.1021/ci990131nopenalex-snapshot
QM/NN QSPR Models with Error Estimation: Vapor Pressure and LogP
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Potential Drugs and Nondrugs: Prediction and Identification of Important Structural Features
inferredcites →https://doi.org/10.1021/j100139a019openalex-snapshot
Relationships of critical constants and boiling points to computed molecular surface properties
inferredcites →https://doi.org/10.1021/ja00299a024openalex-snapshot
Development and use of quantum mechanical molecular models. 76. AM1: a new general purpose quantum mechanical molecular model
inferredcites →https://doi.org/10.1021/jm970666copenalex-snapshot
Can We Learn To Distinguish between “Drug-like” and “Nondrug-like” Molecules?
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A Scoring Scheme for Discriminating between Drugs and Nondrugs
inferredcites →https://doi.org/10.1039/a702584jopenalex-snapshot
A model based QSPR analysis of the unified non-specific solvent polarity scale
inferredcites →https://doi.org/10.1039/a802302fopenalex-snapshot
Using theoretical descriptors in quantitative structure–property relationships: some distribution equilibria
inferredcites →https://doi.org/10.1039/cs9861500475openalex-snapshot
Theoretical models of charge-transfer complexes
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American Medical Association
inferredcites →https://doi.org/10.1080/00401706.1988.10488412openalex-snapshot
Principal Component Analysis
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The Scree Test For The Number Of Factors
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A Comprehensive Trial Of The Scree And Kg Criteria For Determining The Number Of Factors
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inferred← citeshttps://doi.org/10.1016/j.ejps.2007.02.001openalex-snapshot
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