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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: 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: Naziha Bakouh, Dominique Eladari, Maxime Louet, Maria A. Miteva, Bruno O. Villoutreix, Yohan Bignon, Gabrielle Planelles, Jacques Teulon, Sara Bitam, David Lagorce
المساهمون: Molécules Thérapeutiques in silico (MTI), Université Paris Diderot - Paris 7 (UPD7)-Institut National de la Santé et de la Recherche Médicale (INSERM), Centre de Recherche des Cordeliers (CRC), Université Paris Diderot - Paris 7 (UPD7)-École pratique des hautes études (EPHE), Université Paris sciences et lettres (PSL)-Université Paris sciences et lettres (PSL)-Université Pierre et Marie Curie - Paris 6 (UPMC)-Université Paris Descartes - Paris 5 (UPD5)-Institut National de la Santé et de la Recherche Médicale (INSERM), Diabète athérothrombose et thérapies Réunion Océan Indien (DéTROI), Institut National de la Santé et de la Recherche Médicale (INSERM)-Université de La Réunion (UR), Service d’Explorations Fonctionnelles Rénales, Centre hospitalier Félix-Guyon [Saint-Denis, La Réunion], HAL UPMC, Gestionnaire, Université Pierre et Marie Curie - Paris 6 (UPMC)-École pratique des hautes études (EPHE), Université Paris sciences et lettres (PSL)-Université Paris sciences et lettres (PSL)-Université Paris Diderot - Paris 7 (UPD7)-Université Paris Descartes - Paris 5 (UPD5)-Institut National de la Santé et de la Recherche Médicale (INSERM), Université de La Réunion (UR)-Institut National de la Santé et de la Recherche Médicale (INSERM), Molécules Thérapeutique in silico, Recherche de molécules à visée thérapeutique par approches In Silico ( MTI ), Université Paris Diderot - Paris 7 ( UPD7 ) -Institut National de la Santé et de la Recherche Médicale ( INSERM ), Centre de Recherche des Cordeliers ( CRC ), Université Paris Diderot - Paris 7 ( UPD7 ) -École pratique des hautes études ( EPHE ) -Université Pierre et Marie Curie - Paris 6 ( UPMC ) -Université Paris Descartes - Paris 5 ( UPD5 ) -Institut National de la Santé et de la Recherche Médicale ( INSERM ), Diabète athérothrombose et thérapies Réunion Océan Indien ( DéTROI ), Institut National de la Santé et de la Recherche Médicale ( INSERM ) -Université de la Réunion ( UR ), CHU Félix Guyon, Université Pierre et Marie Curie - Paris 6 (UPMC)-École Pratique des Hautes Études (EPHE)
المصدر: Scientific Reports
Scientific Reports, Nature Publishing Group, 2017, 7, pp.7249. ⟨10.1038/s41598-017-07794-5⟩
Scientific Reports, 2017, 7, pp.7249. ⟨10.1038/s41598-017-07794-5⟩
Scientific Reports, Nature Publishing Group, 2017, 7, pp.7249. 〈10.1038/s41598-017-07794-5〉
Scientific Reports, Vol 7, Iss 1, Pp 1-15 (2017)مصطلحات موضوعية: 0301 basic medicine, Models, Molecular, Quantitative structure–activity relationship, [SDV.BBM.BS] Life Sciences [q-bio]/Biochemistry, Molecular Biology/Structural Biology [q-bio.BM], Protein Conformation, Science, [CHIM.THER] Chemical Sciences/Medicinal Chemistry, In silico, Drug Evaluation, Preclinical, Quantitative Structure-Activity Relationship, Computational biology, [CHIM.THER]Chemical Sciences/Medicinal Chemistry, Pharmacology, Bartter syndrome, Article, Membrane Potentials, 03 medical and health sciences, Protein structure, Chlorides, Chloride Channels, medicine, Animals, Humans, Amino Acid Sequence, Membrane potential, Virtual screening, Multidisciplinary, Molecular Structure, [SDV.BBM.BS]Life Sciences [q-bio]/Biochemistry, Molecular Biology/Structural Biology [q-bio.BM], Chemistry, [ CHIM.THER ] Chemical Sciences/Medicinal Chemistry, medicine.disease, 3. Good health, Drug repositioning, 030104 developmental biology, Mutation, Chloride channel, Medicine, Cattle, Disease Susceptibility, Ion Channel Gating, [ SDV.BBM.BS ] Life Sciences [q-bio]/Biochemistry, Molecular Biology/Biomolecules [q-bio.BM]
وصف الملف: application/pdf
الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::8cc71b54f23fb0454d678dbf974777f4Test
https://hal.sorbonne-universite.fr/hal-01580157/file/s41598-017-07794-5.pdfTest -
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المؤلفون: Jonathan B. Baell, Julien Maupetit, David Lagorce, Hervé Galons, Bruno O. Villoutreix, Maria A. Miteva, Pierre Tufféry, Olivier Sperandio
المصدر: Bioinformatics. 27:2018-2020
مصطلحات موضوعية: Statistics and Probability, Internet, Web server, Virtual screening, Database, business.industry, Computer science, Application server, computer.software_genre, Online Systems, Biochemistry, Computer Science Applications, Small Molecule Libraries, World Wide Web, Computational Mathematics, Pharmaceutical Preparations, Computational Theory and Mathematics, Web application, Computer Simulation, Hit selection, Electronics, business, Molecular Biology, computer, Software
الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::a79b19a516a3ea3c102cc9f7de127dddTest
https://doi.org/10.1093/bioinformatics/btr333Test -
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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: David Lagorce, Bruno O. Villoutreix, Maria A. Miteva
المصدر: Expert opinion on drug discovery. 6(3)
مصطلحات موضوعية: Structure (mathematical logic), Virtual screening, Speedup, Drug discovery, Computer science, business.industry, Distributed computing, media_common.quotation_subject, Process (computing), Software, Drug Discovery, Quality (business), business, Simulation, Generator (mathematics), media_common
الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::241393ef514f18803f12d121b743bd8cTest
https://pubmed.ncbi.nlm.nih.gov/22647207Test -
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المصدر: Methods in Molecular Biology ISBN: 9781617794643
مصطلحات موضوعية: Identification (information), Virtual screening, ComputingMethodologies_PATTERNRECOGNITION, Lead (geology), Software, Drug discovery, Computer science, business.industry, Interface (computing), In silico, Software engineering, business, Automation
الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_________::9fcdb7ee01bc00af4e9824b4406643daTest
https://doi.org/10.1007/978-1-61779-465-0_9Test -
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المؤلفون: Tania Pencheva, Bruno O. Villoutreix, David Lagorce, Maria A. Miteva
المساهمون: Molécules Thérapeutiques in silico (MTI), Université Paris Diderot - Paris 7 (UPD7)-Institut National de la Santé et de la Recherche Médicale (INSERM), Centre of Biomedical Engineering, Bulgarian Academy of Sciences (BAS), We would like to thank the Inserm institute, Paris Descartes University and Paris Diderot University for supports. TP thanks the 'Mairie de Paris' fellowship and the National Science Fund of Bulgaria, BMC, Ed.
المصدر: BMC Chemical Biology
BMC Chemical Biology, BioMed Central, 2009, 9 (1), pp.6. ⟨10.1186/1472-6769-9-6⟩
BMC Chemical Biology, Vol 9, Iss 1, p 6 (2009)مصطلحات موضوعية: Computer science, In silico, Nanotechnology, Energy minimization, 01 natural sciences, Molecular mechanics, Computational science, lcsh:Biochemistry, 03 medical and health sciences, Drug Discovery, lcsh:QD415-436, [SDV.BBM.BC]Life Sciences [q-bio]/Biochemistry, Molecular Biology/Biochemistry [q-bio.BM], [SDV.BBM.BC] Life Sciences [q-bio]/Biochemistry, Molecular Biology/Biochemistry [q-bio.BM], [INFO.INFO-BI] Computer Science [cs]/Bioinformatics [q-bio.QM], 030304 developmental biology, 0303 health sciences, Virtual screening, [SDV.BIBS] Life Sciences [q-bio]/Quantitative Methods [q-bio.QM], Drug discovery, Process (computing), [SDV.BIBS]Life Sciences [q-bio]/Quantitative Methods [q-bio.QM], Small molecule, [SDV.BBM.BC]Life Sciences [q-bio]/Biochemistry, Molecular Biology/Biomolecules [q-bio.BM], 0104 chemical sciences, 010404 medicinal & biomolecular chemistry, Molecular Medicine, [INFO.INFO-BI]Computer Science [cs]/Bioinformatics [q-bio.QM], Software, Generator (mathematics)
وصف الملف: application/pdf
الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::fa10968df03b3c22dbaed8f0f5dc908dTest
https://doi.org/10.1186/1472-6769-9-6Test -
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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
