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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: Zhe Zhang, David Lagorce, Emil Alexov, Virginie Y. Martiny, Maria A. Miteva, Yoshihiko Ikeguchi
المصدر: PLoS ONE, Vol 9, Iss 10, p e110884 (2014)
PLoS ONEمصطلحات موضوعية: Protein Conformation, Chemistry, Pharmaceutical, Spermine Synthase, Mutant, Biophysics, Mutation, Missense, lcsh:Medicine, Molecular Dynamics Simulation, Crystallography, X-Ray, Protein structure, Intellectual Disability, Protein Interaction Mapping, Humans, Binding site, lcsh:Science, Genetics, Virtual screening, Binding Sites, Multidisciplinary, biology, Chemistry, lcsh:R, Rational design, Biology and Life Sciences, Computational Biology, Small molecule, Spermine synthase, Drug Design, Mutation, Mental Retardation, X-Linked, biology.protein, Thermodynamics, lcsh:Q, Protein Multimerization, Small molecule binding, Research Article, Protein Binding
الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::ca27c4ced8eeedc3221e35f57cf57301Test
http://europepmc.org/articles/PMC4207787?pdf=renderTest -
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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: 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 -
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المصدر: BMC Bioinformatics
BMC Bioinformatics, Vol 9, Iss 1, p 438 (2008)مصطلحات موضوعية: Models, Molecular, Computer science, In silico, Binding pocket, Neuraminidase, lcsh:Computer applications to medicine. Medical informatics, Ligands, Energy minimization, Bioinformatics, Biochemistry, Molecular mechanics, Force field (chemistry), Small Molecule Libraries, Structural Biology, Binding site, lcsh:QH301-705.5, Molecular Biology, Virtual screening, Binding Sites, Drug discovery, Ligand, Methodology Article, Applied Mathematics, Proteins, A protein, computer.file_format, Protein Data Bank, Small molecule, Computer Science Applications, lcsh:Biology (General), Receptors, Estrogen, Drug Design, Proteins metabolism, lcsh:R858-859.7, Thermodynamics, Biochemical engineering, DNA microarray, computer, Algorithms, Software
الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::e12e8da5859f1eae6817fb7b4deae6ffTest
https://doi.org/10.1186/1471-2105-9-438Test -
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المؤلفون: Maria A. Miteva, Nicolas Sauton, David Lagorce, Bruno O. Villoutreix
المصدر: BMC Bioinformatics
BMC Bioinformatics, Vol 9, Iss 1, p 184 (2008)مصطلحات موضوعية: Models, Molecular, Databases, Factual, Computer science, Molecular Conformation, lcsh:Computer applications to medicine. Medical informatics, Ligands, Bioinformatics, Biochemistry, Molecular conformation, Computational science, User-Computer Interface, Isomerism, Structural Biology, DOCK, Molecule, Computer Simulation, Particle Size, Binding site, lcsh:QH301-705.5, Molecular Biology, Conformational isomerism, Virtual screening, Binding Sites, Ligand, Methodology Article, Applied Mathematics, Computational Biology, Computer Science Applications, lcsh:Biology (General), Protein–ligand docking, Docking (molecular), lcsh:R858-859.7, DNA microarray, Algorithms, Protein Binding
الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::d3e9efb6d4a37ddfc3fc34464c64f7d7Test
https://doi.org/10.1186/1471-2105-9-184Test -
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المؤلفون: Nicolas Renault, Bruno O. Villoutreix, Maria A. Miteva, Matthieu Montes, David Lagorce, Olivier Sperandio
المصدر: ResearcherID
مصطلحات موضوعية: Computer science, In silico, Druggability, Quantitative Structure-Activity Relationship, Nanotechnology, Ligands, Biochemistry, Structural bioinformatics, Databases, Genetic, Macromolecular docking, Databases, Protein, Molecular Biology, Information Services, Internet, Binding Sites, Molecular Structure, business.industry, Drug discovery, Computational Biology, Cell Biology, General Medicine, Data science, Docking (molecular), Cheminformatics, Drug Design, Computer-Aided Design, The Internet, business, Algorithms, Software
الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::4b9828e1eb097cc4d2c13c4a6e807ae8Test
https://pubmed.ncbi.nlm.nih.gov/17696871Test