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Comparing Multilabel Classification Methods for Provisional Biopharmaceutics Class Prediction
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What this work says
Outgoing claims: the papers this work cites, builds on, or argues with.
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Biowaiver Monographs for Immediate Release Solid Oral Dosage Forms: Diclofenac Sodium and Diclofenac Potassium
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The Developability Classification System: Application of Biopharmaceutics Concepts to Formulation Development
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Biowaiver Approach for Biopharmaceutics Classification System Class 3 Compound Metformin Hydrochloride Using In Silico Modeling
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Predicting Drug Disposition via Application of BCS: Transport/Absorption/ Elimination Interplay and Development of a Biopharmaceutics Drug Disposition Classification System
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Computational Models to Assign Biopharmaceutics Drug Disposition Classification from Molecular Structure
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Symptom selection for multi-label data of inquiry diagnosis in traditional Chinese medicine
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Iterative partial equalization of orbital electronegativity—a rapid access to atomic charges
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Classification and regression trees
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Aqueous solubilities of some variously substituted quinolone antimicrobials
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New QSPR study for the prediction of aqueous solubility of drug-like compounds
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QSAR-based solubility model for drug-like compounds
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QSAR-based permeability model for drug-like compounds
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Decision trees to characterise the roles of permeability and solubility on the prediction of oral absorption
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Classification of orally administered drugs on the World Health Organization Model list of Essential Medicines according to the biopharmaceutics classification system
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Estimation of drug solubility in water, PEG 400 and their binary mixtures using the molecular structures of solutes
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Is the full potential of the biopharmaceutics classification system reached?
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The impact of training set data distributions for modelling of passive intestinal absorption
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A non-binary biopharmaceutical classification of drugs: The ABΓ system
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HPLC and solubility study of the interaction between pindolol and cyclodextrins
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Experimental and computational approaches to estimate solubility and permeability in drug discovery and development settings
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VolSurf: a new tool for the pharmacokinetic optimization of lead compounds
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Drug-like properties and the causes of poor solubility and poor permeability
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Prediction of Aqueous Solubility of Organic Compounds
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Global and Local Computational Models for Aqueous Solubility Prediction of Drug-Like Molecules
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Coping with Unbalanced Class Data Sets in Oral Absorption Models
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Pre-processing Feature Selection for Improved C&RT Models for Oral Absorption
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In Silico Prediction of Aqueous Solubility: The Solubility Challenge
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Comparison of Multilabel and Single-Label Classification Applied to the Prediction of the Isoform Specificity of Cytochrome P450 Substrates
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Absorption Classification of Oral Drugs Based on Molecular Surface Properties
inferredcites →https://doi.org/10.1021/jm701587dopenalex-snapshot
Molecular Characteristics for Solid-State Limited Solubility
inferredcites →https://doi.org/10.1021/js9804011openalex-snapshot
Rapid calculation of polar molecular surface area and its application to the prediction of transport phenomena. 1. Prediction of intestinal absorption
inferredcites →https://doi.org/10.1021/mp034006hopenalex-snapshot
Molecular Properties of WHO Essential Drugs and Provisional Biopharmaceutical Classification
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A Provisional Biopharmaceutical Classification of the Top 200 Oral Drug Products in the United States, Great Britain, Spain, and Japan
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BDDCS Class Prediction for New Molecular Entities
inferredcites →https://doi.org/10.1021/mp2004912openalex-snapshot
pH-Dependent Solubility and Permeability Criteria for Provisional Biopharmaceutics Classification (BCS and BDDCS) in Early Drug Discovery
inferredcites →https://doi.org/10.1021/mp4000585openalex-snapshot
Provisional Classification and in Silico Study of Biopharmaceutical System Based on Caco-2 Cell Permeability and Dose Number
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Aqueous Solubility Prediction: Do Crystal Lattice Interactions Help?
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BoosTexter: A Boosting-based System for Text Categorization
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An Evaluation of Statistical Approaches to Text Categorization
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Experimental and Computational Screening Models for Prediction of Aqueous Drug Solubility
inferredcites →https://doi.org/10.1023/a:1016212804288openalex-snapshot
A Theoretical Basis for a Biopharmaceutic Drug Classification: The Correlation of in Vitro Drug Product Dissolution and in Vivo Bioavailability
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The Impact of variable selection on the modelling of oestrogenicity
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A Genetic Algorithm for Optimizing the Label Ordering in Multi-label Classifier Chains
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Multi-labelled classification using maximum entropy method
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Predicting gene function using hierarchical multi-label decision tree ensembles
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Waiver of In Vivo Bioavailability and Bioequivalence Studies for Immediate-Release Solid Oral Dosage Forms Based on a Biopharmaceutics Classification System
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Use of the Biopharmaceutical Classification System in Early Drug Development
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Prediction of Solubility and Permeability Class Membership: Provisional BCS Classification of the World’s Top Oral Drugs
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The use of biopharmaceutic classification of drugs in drug discovery and development: current status and future extension
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Pharmacokinetics of Rofecoxib
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Martindale: the complete drug reference
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Multilabel and Missing Label Methods for Binary Quantitative Structure–Activity Relationship Models: An Application for the Prediction of Adverse Drug Reactions
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In Silico Assessment of ADME Properties: Advances in Caco-2 Cell Monolayer Permeability Modeling
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Reliable Prediction of Caco-2 Permeability by Supervised Recursive Machine Learning Approaches
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