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Rank Order Entropy: Why One Metric Is Not Enough
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Outgoing claims: the papers this work cites, builds on, or argues with.
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Transferable atom equivalent multicentered multipole expansion method
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Statistical variation in progressive scrambling
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Discovery and SAR study of novel dihydroquinoline containing glucocorticoid receptor ligands
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Pyrrolidines as potent functional agonists of the human melanocortin-4 receptor
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Discovery and SAR study of novel dihydroquinoline-containing glucocorticoid receptor agonists
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HERG binding specificity and binding site structure: evidence from a fragment-based evolutionary computing SAR study
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Prediction of hERG potassium channel affinity by traditional and hologram qSAR methods
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A widely applicable set of descriptors
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ESOL: Estimating Aqueous Solubility Directly from Molecular Structure
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Development of QSAR Models To Predict and Interpret the Biological Activity of Artemisinin Analogues
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Quantitative Structure−Activity Relationship Studies on Inhibition of HERG Potassium Channels
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Comparative Quantitative Structure−Activity Relationship Studies on Anti-HIV Drugs
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Molecular Properties That Influence the Oral Bioavailability of Drug Candidates
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Novel Series of Potent, Nonsteroidal, Selective Androgen Receptor Modulators Based on 7H-[1,4]Oxazino[3,2-g]quinolin-7-ones
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Selective Inhibition of Carboxylesterases by Isatins, Indole-2,3-diones
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Synthesis and Evaluation of 7H-8,9-Dihydropyrano[2,3-c]imidazo[1,2-a]pyridines as Potassium-Competitive Acid Blockers
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Thermodynamic and Structure Guided Design of Statin Based Inhibitors of 3-Hydroxy-3-Methylglutaryl Coenzyme A Reductase
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4-(Phenylaminomethylene)isoquinoline-1,3(2H,4H)-diones as Potent and Selective Inhibitors of the Cyclin-Dependent Kinase 4 (CDK4)
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Synthesis and Evaluation of Structurally Constrained Quinazolinone Derivatives as Potent and Selective Histamine H3Receptor Inverse Agonists
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New Benzylureas as a Novel Series of Potent, Nonpeptidic Vasopressin V2 Receptor Agonists
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Phosphonosulfonates Are Potent, Selective Inhibitors of Dehydrosqualene Synthase and Staphyloxanthin Biosynthesis in Staphylococcus aureus
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Second-Generation Highly Potent and Selective Inhibitors of the Hepatitis C Virus NS3 Serine Protease
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Inhibition of Subgenomic Hepatitis C Virus RNA Replication by Acridone Derivatives: Identification of an NS3 Helicase Inhibitor
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8-(4-Methoxyphenyl)pyrazolo[1,5-a]-1,3,5-triazines: Selective and Centrally Active Corticotropin-Releasing Factor Receptor-1 (CRF1) Antagonists
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1-Sulfonyl-4-acylpiperazines as Selective Cannabinoid-1 Receptor (CB1R) Inverse Agonists for the Treatment of Obesity
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Structure−Affinity Relationships of Glutamine Mimics Incorporated into Phosphopeptides Targeted to the SH2 Domain of Signal Transducer and Activator of Transcription 3
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Structure-Based Alignment and Comparative Molecular Field Analysis of Acetylcholinesterase Inhibitors
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Computation of Brain−Blood Partitioning of Organic Solutes via Free Energy Calculations
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Three-Dimensional Quantitative Structure−Activity Relationship Analyses Using Comparative Molecular Field Analysis and Comparative Molecular Similarity Indices Analysis To Elucidate Selectivity Differences of Inhibitors Binding to Trypsin, Thrombin, and Factor Xa
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Functional Role of P-Glycoprotein in Limiting Intestinal Absorption of Drugs: Contribution of Passive Permeability to P-Glycoprotein Mediated Efflux Transport
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The CoMFA steroids as a benchmark dataset for development of 3D QSAR methods
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New developments in PEST shape/property hybrid descriptors
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Quantitative Structure-Activity Relationship (QSAR) Models of Mutagens and Carcinogens
What points at this work
Incoming claims: where this work appears in other papers’ reference lists and arguments.
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Impact of distance-based metric learning on classification and visualization model performance and structure–activity landscapes
inferred← citeshttps://doi.org/10.1016/j.bcp.2013.10.031openalex-snapshot
Human heart failure: Is cell therapy a valid option?
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Introduction of rm2(rank) metric incorporating rank-order predictions as an additional tool for validation of QSAR/QSPR models
inferred← citeshttps://doi.org/10.1021/acs.jcim.7b00492openalex-snapshot
Advantages of Relative versus Absolute Data for the Development of Quantitative Structure–Activity Relationship Classification Models
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2-Aminomethylene-5-sulfonylthiazole Inhibitors of Lysyl Oxidase (LOX) and LOXL2 Show Significant Efficacy in Delaying Tumor Growth
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QSAR classification and regression models for β-secretase inhibitors using relative distance matrices
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In silico studies on recreational drugs: 3D quantitative structure activity relationship prediction of classified and de novo designer benzodiazepines
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Cardiomyogenesis in the Aging and Failing Human Heart
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Quantifying uncertainty due to sampling error in a social vulnerability index: A Monte Carlo approach
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Applications of Entropy in Data Analysis and Machine Learning: A Review
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