Designing focused chemical libraries enriched in protein-protein interaction inhibitors using machine-learning methods
about
Open Babel: An open chemical toolboxSystematic analysis of helical protein interfaces reveals targets for synthetic inhibitorsSmall Molecule Targeting of Protein-Protein Interactions through Allosteric Modulation of DynamicsChemical libraries dedicated to protein-protein interactionsThe Chemical Information Ontology: provenance and disambiguation for chemical data on the biological semantic webOrder and disorder in large multi-site docking proteins of the Gab family--implications for signalling complex formation and inhibitor design strategiesEnabling large-scale design, synthesis and validation of small molecule protein-protein antagonistsModulating protein-protein interactions with small molecules: the importance of binding hotspots.A common structural blueprint for plant UDP-sugar-producing pyrophosphorylases.A leap into the chemical space of protein-protein interaction inhibitorsOvercoming Chemical, Biological, and Computational Challenges in the Development of Inhibitors Targeting Protein-Protein Interactions.2P2Idb: a structural database dedicated to orthosteric modulation of protein-protein interactions.Plucking the high hanging fruit: a systematic approach for targeting protein-protein interactionsDesign of libraries targeting protein-protein interfaces.2P2I HUNTER: a tool for filtering orthosteric protein-protein interaction modulators via a dedicated support vector machine.HADDOCK(2P2I): a biophysical model for predicting the binding affinity of protein-protein interaction inhibitors.Rational design of topographical helix mimics as potent inhibitors of protein-protein interactions.Focused chemical libraries--design and enrichment: an example of protein-protein interaction chemical space.TNF superfamily protein-protein interactions: feasibility of small- molecule modulationComputational and biophysical approaches to protein-protein interaction inhibition of Plasmodium falciparum AMA1/RON2 complex.Medicinal chemistry for 2020Pharmacological manipulation of transcription factor protein-protein interactions: opportunities and obstaclesMTiOpenScreen: a web server for structure-based virtual screening.FAF-Drugs3: a web server for compound property calculation and chemical library design.State-of-the-art strategies for targeting protein-protein interactions by small-molecule inhibitors.Comparative Analysis of Virtual Screening Approaches in the Search for Novel EphA2 Receptor Antagonists.Imbalance in chemical space: How to facilitate the identification of protein-protein interaction inhibitors.Scaling the druggability landscape of human bromodomains, a new class of drug targets.Flexibility and small pockets at protein-protein interfaces: New insights into druggability.Chemistry and biology of multicomponent reactions.Druggability assessment of protein-protein interfaces.Structure-Based Design of Inhibitors of Protein-Protein Interactions: Mimicking Peptide Binding Epitopes.Analysis and Ranking of Protein-Protein Docking Models Using Inter-Residue Contacts and Inter-Molecular Contact Maps.Medicinal Chemistry Strategies to Disrupt the p53-MDM2/MDMX Interaction.Computational Biology and Chemistry in MTi: Emphasis on the Prediction of Some ADMET Properties.Computational probing protein-protein interactions targeting small molecules.Towards the Next Generation of Computational Chemogenomics Tools.Drug-Like Protein-Protein Interaction Modulators: Challenges and Opportunities for Drug Discovery and Chemical Biology.Exploring NMR ensembles of calcium binding proteins: perspectives to design inhibitors of protein-protein interactionsAntibacterial Evaluation and Virtual Screening of New Thiazolyl-Triazole Schiff Bases as Potential DNA-Gyrase Inhibitors.
P2860
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P2860
Designing focused chemical libraries enriched in protein-protein interaction inhibitors using machine-learning methods
description
2010 nî lūn-bûn
@nan
2010 թուականի Մարտին հրատարակուած գիտական յօդուած
@hyw
2010 թվականի մարտին հրատարակված գիտական հոդված
@hy
2010年の論文
@ja
2010年論文
@yue
2010年論文
@zh-hant
2010年論文
@zh-hk
2010年論文
@zh-mo
2010年論文
@zh-tw
2010年论文
@wuu
name
Designing focused chemical lib ...... using machine-learning methods
@ast
Designing focused chemical lib ...... using machine-learning methods
@en
Designing focused chemical lib ...... using machine-learning methods
@nl
type
label
Designing focused chemical lib ...... using machine-learning methods
@ast
Designing focused chemical lib ...... using machine-learning methods
@en
Designing focused chemical lib ...... using machine-learning methods
@nl
prefLabel
Designing focused chemical lib ...... using machine-learning methods
@ast
Designing focused chemical lib ...... using machine-learning methods
@en
Designing focused chemical lib ...... using machine-learning methods
@nl
P2093
P2860
P3181
P1476
Designing focused chemical lib ...... using machine-learning methods
@en
P2093
Anne Mazars
Anne-Claude Camproux
Bruno O Villoutreix
Christelle Reynès
Florence Leroux
Guillaume Laconde
Hélène Host
Robin Fahraeus
P2860
P304
P3181
P356
10.1371/JOURNAL.PCBI.1000695
P407
P577
2010-03-05T00:00:00Z