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المؤلفون: Céline M. Labbé, Mélaine A. Kuenemann, David Lagorce, Bruno O. Villoutreix, Maria A. Miteva, Olivier Sperandio
المصدر: Progress in Biophysics and Molecular Biology. 119:20-32
مصطلحات موضوعية: Virtual screening, Computer science, Drug discovery, In silico, Biophysics, food and beverages, Ligands, Bioinformatics, Molecular Weight, Small Molecule Libraries, Cheminformatics, Drug Design, Animals, Humans, Computer Simulation, Low molecular weight protein, Protein Interaction Maps, Molecular Biology
الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::e24de5503643d33b8e21c9847753d816Test
https://doi.org/10.1016/j.pbiomolbio.2015.02.006Test -
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المؤلفون: Barbara Zarzycka, David Lagorce, Mélaine A. Kuenemann, Gert Vriend, Céline M. Labbé, Maria A. Miteva, Bruno O. Villoutreix, Olivier Sperandio, Gerry A. F. Nicolaes
المساهمون: Promovendi CD, Biochemie, RS: CARIM - R1.01 - Blood proteins & engineering
المصدر: Nucleic Acids Research, 44, D542-7
Nucleic Acids Research, 44(D1), D542-D547. Oxford University Press
Nucleic Acids Research
Nucleic Acids Research, 44, D1, pp. D542-7مصطلحات موضوعية: 0301 basic medicine, Internet, Online database, Proteins, Computational biology, Chemical similarity, Biology, Bioinformatics, chEMBL, Chemical space, 3. Good health, 03 medical and health sciences, Identification (information), 030104 developmental biology, Pharmaceutical Preparations, Drug Discovery, Protein Interaction Mapping, Genetics, Database Issue, Table (database), UniProt, Databases, Protein, Nanomedicine Radboud Institute for Molecular Life Sciences [Radboudumc 19], PubChem
وصف الملف: application/pdf
الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::ea71e1cf78b9663b10f9da5271a27af5Test
https://doi.org/10.1093/nar/gkv982Test -
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المصدر: Bioinformatics. 33:3658-3660
مصطلحات موضوعية: 0301 basic medicine, Statistics and Probability, Service (systems architecture), In silico, media_common.quotation_subject, Biology, Bioinformatics, 01 natural sciences, Biochemistry, 03 medical and health sciences, Annotation, Software, Drug Discovery, Computer Simulation, Quality (business), Molecular Biology, Selection (genetic algorithm), media_common, Information retrieval, 010405 organic chemistry, business.industry, Drug discovery, Computational Biology, 0104 chemical sciences, Computer Science Applications, Computational Mathematics, Identification (information), 030104 developmental biology, Computational Theory and Mathematics, business
الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::0fb4d7a3f5e28ad4e80206f01bb46a74Test
https://doi.org/10.1093Test/bioinformatics /btx491 -
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المؤلفون: David Lagorce, Jonathan B. Baell, Bruno O. Villoutreix, Maria A. Miteva, Olivier Sperandio
المصدر: Nucleic Acids Research
مصطلحات موضوعية: Internet, Web server, Information retrieval, Download, Drug discovery, Biology, Bioinformatics, computer.software_genre, Field (computer science), Chemical library, Pan-assay interference compounds, chemistry.chemical_compound, Pharmaceutical Preparations, chemistry, Filter (video), Drug Discovery, Genetics, Web Server issue, Pharmacokinetics, Hit selection, computer, Software
الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::7e5b1ee773a3a3c8b6da79cc0bdf7edfTest
https://doi.org/10.1093/nar/gkv353Test -
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المؤلفون: Pierre Tufféry, Olivier Sperandio, Maria A. Miteva, Jerome Becot, Marek Vavrusa, Julien Rey, Bruno O. Villoutreix, David Lagorce, Céline M. Labbé
المصدر: Nucleic Acids Research
مصطلحات موضوعية: Web server, Protein Conformation, Biology, computer.software_genre, Bioinformatics, Ligands, Molecular Docking Simulation, World Wide Web, 03 medical and health sciences, 0302 clinical medicine, Drug Discovery, Genetics, Web Server issue, 030304 developmental biology, 0303 health sciences, Virtual screening, Internet, Binding Sites, business.industry, Drug discovery, Proteins, AutoDock, 3. Good health, Pharmaceutical Preparations, Docking (molecular), 030220 oncology & carcinogenesis, The Internet, business, computer, PubChem, Software
الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::609b352d97dadfbaae377d8077a3131bTest
http://europepmc.org/articles/PMC4489289Test -
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المؤلفون: Heriberto Bruzzoni-Giovanelli, Maria A. Miteva, Bruno O. Villoutreix, Mélaine A. Kuenemann, Jean-Luc Poyet, Olivier Sperandio, David Lagorce, Céline M. Labbé
المصدر: Molecular Informatics
مصطلحات موضوعية: Drug, PPI network, media_common.quotation_subject, In silico, Chemical biology, Computational biology, Review, Biology, Bioinformatics, Protein–protein interaction, 03 medical and health sciences, 0302 clinical medicine, Structural Biology, Experimental work, Protein–protein interaction modulators, 030304 developmental biology, media_common, 0303 health sciences, Drug discovery, Organic Chemistry, In silico methods, Limiting, 3. Good health, Computer Science Applications, 13. Climate action, Cheminformatics, 030220 oncology & carcinogenesis, Drug-like molecules, Molecular Medicine
الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::e3eda4604912a4e4e96083200185c0a5Test
http://europepmc.org/articles/PMC4160817Test -
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المؤلفون: Mélaine A. Kuenemann, Olivier Sperandio, David Lagorce, Bruno O. Villoutreix, Maria A. Miteva
المصدر: In Silico Drug Discovery and Design ISBN: 9781482217834
In Silico Drug Discovery and Design: Theory, Methods, Challenges, and Applicationsمصطلحات موضوعية: Chemistry, In silico, Rational design, Low molecular weight protein, Protein–protein interaction prediction, Computational biology, Bioinformatics
الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_________::647c101d3f228b2ca9224472de5eab43Test
https://doi.org/10.1201/b18799-21Test -
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المؤلفون: Pablo Carbonell, Gautier Moroy, Bruno O. Villoutreix, Maria A. Miteva, David Lagorce, Virginie Y. Martiny
المصدر: PLoS ONE
PLoS ONE, Vol 8, Iss 9, p e73587 (2013)مصطلحات موضوعية: Models, Molecular, Quantitative structure–activity relationship, In silico, Science, Quantitative Structure-Activity Relationship, Computational biology, Molecular Dynamics Simulation, Bioinformatics, Crystallography, X-Ray, Ligands, 01 natural sciences, Xenobiotics, Small Molecule Libraries, 03 medical and health sciences, 0103 physical sciences, Humans, Computer Simulation, Binding site, 030304 developmental biology, 0303 health sciences, Multidisciplinary, Binding Sites, 010304 chemical physics, Molecular Structure, Chemistry, Ligand (biochemistry), Small molecule, Arylsulfotransferase, 3. Good health, Protein Structure, Tertiary, Docking (molecular), Medicine, Thermodynamics, Small molecule binding, Sulfotransferases, Research Article, Protein Binding
الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::df34ff7e23334479f964e7ad71caccb9Test
http://europepmc.org/articles/PMC3765257Test -
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المؤلفون: Christelle Reynes, Bruno O. Villoutreix, Philippe Vayer, Florent Chevillard, David Lagorce, Maria A. Miteva
المصدر: Molecular pharmaceutics. 9(11)
مصطلحات موضوعية: Molecular Structure, Chemistry, In silico, Reliability (computer networking), Pharmaceutical Science, Quantitative Structure-Activity Relationship, Water, Chemical similarity, Bioinformatics, computer.software_genre, Random forest, Data set, Models, Chemical, Pharmaceutical Preparations, Solubility, Test set, Drug Discovery, Molecular Medicine, Computer Simulation, Data mining, computer, Protocol (object-oriented programming), Software
الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::1edf7fed619cef10b7ec40785aeb6827Test
https://pubmed.ncbi.nlm.nih.gov/23072744Test -
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المؤلفون: Olivier Sperandio, Guillaume Laconde, David Lagorce, Bruno O. Villoutreix, Céline M. Labbé
المساهمون: Molécules Thérapeutiques in silico (MTI), Université Paris Diderot - Paris 7 (UPD7)-Institut National de la Santé et de la Recherche Médicale (INSERM), Sperandio, Olivier
المصدر: Current Pharmaceutical Design
Current Pharmaceutical Design, Bentham Science Publishers, 2012, 18 (30), pp.4648-67
Protein-Protein Interactions in Drug Discoveryمصطلحات موضوعية: Druggability, protein-protein interactions, Bioinformatics, therapeutic targets, 01 natural sciences, Drug likeness, Drug Discovery, MESH: Proteins, Protein Interaction Maps, Enzyme Inhibitors, Chemical space, MESH: Protein Interaction Maps, [INFO.INFO-BI] Computer Science [cs]/Bioinformatics [q-bio.QM], Principal Component Analysis, 0303 health sciences, [SDV.BIBS] Life Sciences [q-bio]/Quantitative Methods [q-bio.QM], Chemistry, Drug discovery, [SDV.BIBS]Life Sciences [q-bio]/Quantitative Methods [q-bio.QM], MESH: Enzyme Inhibitors, Design drugs, druggability, Protein Binding, enzymes, Computational biology, chemoinformatics, G-Protein Coupled Receptor (GPCR), Article, Protein–protein interaction, Small Molecule Libraries, 03 medical and health sciences, MESH: Computer Simulation, MESH: Drug Discovery, MESH: Small Molecule Libraries, MESH: Protein Binding, Computer Simulation, Set (psychology), 030304 developmental biology, Pharmacology, MESH: Principal Component Analysis, Binding Sites, 010405 organic chemistry, Proteins, compound collection, mutations, 0104 chemical sciences, MESH: Binding Sites, ADME, [INFO.INFO-BI]Computer Science [cs]/Bioinformatics [q-bio.QM]
وصف الملف: application/pdf
الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::f50673bbfe618e15914c8a432263c815Test
https://www.hal.inserm.fr/inserm-00828202/file/Sperandio-CurrPharmDes-Oct2012-for-HAL.pdfTest
