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Pharmacophore-based virtual screening versus docking-based virtual screening: a benchmark comparison against eight targets

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Outgoing claims: the papers this work cites, builds on, or argues with.

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A detailed comparison of current docking and scoring methods on systems of pharmaceutical relevance
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DockingVersus Pharmacophore Model Generation: A Comparison of High-Throughput Virtual Screening Strategies for the Search of Human Rhinovirus Coat Protein Inhibitors
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Renin, angiotensin and aldosterone system in pathogenesis and management of hypertensive vascular disease
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Integrating molecular design resources within modern drug discovery research: the Roche experience
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Is it possible to increase hit rates in structure-based virtual screening by pharmacophore filtering? An investigation of the advantages and pitfalls of post-filtering
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Molecular recognition of receptor sites using a genetic algorithm with a description of desolvation
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Virtual screening—an overview
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Kinetics and Crystal Structure of the Wild-Type and the Engineered Y101F Mutant of Herpes simplex Virus Type 1 Thymidine Kinase Interacting with (North)-methanocarba-thymidine,
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On Evaluating Molecular-Docking Methods for Pose Prediction and Enrichment Factors
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Protein-Based Virtual Screening of Chemical Databases. 1. Evaluation of Different Docking/Scoring Combinations
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Robust Ligand-Based Modeling of the Biological Targets of Known Drugs
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Unexpected Binding Mode of a Cyclic Sulfamide HIV-1 Protease Inhibitor
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Pharmacophores Incorporating Numerous Excluded Volumes Defined by X-ray Crystallographic Structure in Three-Dimensional Database Searching: Application to the Thyroid Hormone Receptor
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Refinement of Catalyst hypotheses using simplex optimisation
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DOCK 4.0: Search strategies for automated molecular docking of flexible molecule databases
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Structure of a Zn2+-containing D-alanyl-D-alanine-cleaving carboxypeptidase at 2.5 Å resolution
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Virtual screening of chemical libraries
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The Protein Data Bank
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inferredcites →https://doi.org/10.1146/annurev.bi.45.070176.000445openalex-snapshot
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inferredcites →https://doi.org/10.1146/annurev.biophys.33.110502.133613openalex-snapshot
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inferredcites →https://doi.org/10.1210/me.16.3.515openalex-snapshot
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inferredcites →https://doi.org/10.2174/0929867013372481openalex-snapshot
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Incoming claims: where this work appears in other papers’ reference lists and arguments.

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Novel Quadruplex ligands : in silico and in vitro approaches
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