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Scaffold Hopping by Fragment Replacement
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Outgoing claims: the papers this work cites, builds on, or argues with.
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inferredcites →https://doi.org/10.1016/j.drudis.2011.10.024openalex-snapshot
Classification of scaffold-hopping approaches
inferredcites →https://doi.org/10.1016/j.jmgm.2009.09.002openalex-snapshot
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Development of a Method To Consistently Quantify the Structural Distance between Scaffolds and To Assess Scaffold Hopping Potential
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Improved Chemical Text Mining of Patents with Infinite Dictionaries and Automatic Spelling Correction
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inferredcites →https://doi.org/10.1021/ci970429iopenalex-snapshot
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Improved Scoring of Ligand−Protein Interactions Using OWFEG Free Energy Grids
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Drug Rings Database with Web Interface. A Tool for Identifying Alternative Chemical Rings in Lead Discovery Programs
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SHOP: Scaffold HOPping by GRID-Based Similarity Searches
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2,3-Diarylcyclopentenones as Orally Active, Highly Selective Cyclooxygenase-2 Inhibitors
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inferredcites →https://doi.org/10.1093/nar/gks1059openalex-snapshot
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inferredcites →https://doi.org/10.1098/rsif.2009.0170openalex-snapshot
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Bioisosterism: A Useful Strategy for Molecular Modification and Drug Design
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Ultrafast Shape Recognition: Method and Applications
What points at this work
Incoming claims: where this work appears in other papers’ reference lists and arguments.
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FSDscore: An Effective Target‐focused Scoring Criterion for Virtual Screening
inferred← citeshttps://doi.org/10.1002/slct.201801210openalex-snapshot
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Computational Methods for Fragment-Based Ligand Design: Growing and Linking
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inferred← citeshttps://doi.org/10.1016/j.arabjc.2021.103585openalex-snapshot
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SENSAAS-Bioisostere: A computational method for 3D shape-guided bioisosteric replacements and scaffold-hopping
inferred← citeshttps://doi.org/10.1021/acs.chemrestox.0c00006openalex-snapshot
Computational Approaches to Identify Structural Alerts and Their Applications in Environmental Toxicology and Drug Discovery
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Exploring Topological Pharmacophore Graphs for Scaffold Hopping
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FragRep: A Web Server for Structure-Based Drug Design by Fragment Replacement
inferred← citeshttps://doi.org/10.1021/acs.jcim.1c00409openalex-snapshot
Sparse Topological Pharmacophore Graphs for Interpretable Scaffold Hopping
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Deep Generative Models for 3D Linker Design
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inferred← citeshttps://doi.org/10.1021/acs.jmedchem.5c03118openalex-snapshot
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inferred← citeshttps://doi.org/10.1021/acs.jmedchem.6b01437openalex-snapshot
Recent Advances in Scaffold Hopping
inferred← citeshttps://doi.org/10.1021/ci500542eopenalex-snapshot
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inferred← citeshttps://doi.org/10.1021/jacs.5c00330openalex-snapshot
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inferred← citeshttps://doi.org/10.1093/nar/gkw320openalex-snapshot
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Decoding Surface Fingerprints for Protein-Ligand Interactions
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Síntese e exploração de múltiplos vetores sintéticos em fragmentos \"heteroaromáticos do futuro\"
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Deep scaffold hopping with multimodal transformer neural networks
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Deep Scaffold Hopping with Multi-modal Transformer Neural Networks
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Structural Analogy — Direct Similarity Versus Topographical Complementarity
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