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1Academic Journal
مصطلحات موضوعية: drug repurposing, chemoinformatics, SARS-CoV-2, COVID-19, 2019-nCoV, coronavirus
Relation: https://zenodo.org/communities/covid-19; https://doi.org/10.5281/zenodo.3732346; https://doi.org/10.5281/zenodo.3732347; oai:zenodo.org:3732347
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2Report
المؤلفون: Philip Doganis, Georgia Tsiliki, Haralambos Sarimveis, Haralambos Chomenidis, Georgios Drakakis, Egon Willighagen, Barry Hardy
Relation: https://zenodo.org/communities/nanocommons; https://zenodo.org/communities/nsc; https://zenodo.org/communities/eu; https://doi.org/; https://doi.org/10.5281/zenodo.375609; oai:zenodo.org:375609
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3
المؤلفون: Georgios Drakakis, Philip Doganis, Pantelis Sopasakis, Georgia Tsiliki, Charalampos Chomenidis, Angelos Valsamis, Evangelia Anagnostopoulou, Haralambos Sarimveis
المصدر: Chomenidis, C, Drakakis, G, Tsiliki, G, Anagnostopoulou, E, Valsamis, A, Doganis, P, Sopasakis, P & Sarimveis, H 2017, ' Jaqpot Quattro: A Novel Computational Web Platform for Modeling and Analysis in Nanoinformatics ', JOURNAL OF CHEMICAL INFORMATION AND MODELING, vol. 57, no. 9, pp. 2161–2172 . https://doi.org/10.1021/acs.jcim.7b00223
مصطلحات موضوعية: 0301 basic medicine, Informatics, Computer science, General Chemical Engineering, Engineered nanomaterials, nano-QSAR, 02 engineering and technology, Library and Information Sciences, Ontology (information science), computer.software_genre, Field (computer science), Structure-Activity Relationship, User-Computer Interface, 03 medical and health sciences, Engineering, SDG 3 - Good Health and Well-being, Web application, Nanomaterials, Web services, Internet, QSAR, business.industry, Novelty, General Chemistry, 021001 nanoscience & nanotechnology, Data science, Nanostructures, Computer Science Applications, 030104 developmental biology, Systems architecture, The Internet, Data mining, Web service, 0210 nano-technology, business, Nanoinformatics, computer
وصف الملف: application/pdf
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4
المؤلفون: Andreas Bender, Georgios Drakakis, Suzanne C. Brewerton, Keith A. Wafford, David A. Evans, Michael J. Bodkin
المصدر: ACS Chemical Biology. 12:1593-1602
مصطلحات موضوعية: 0301 basic medicine, Biomedical Research, Polypharmacology, In silico, Pharmacology, Biology, Ecopipam, Biochemistry, 03 medical and health sciences, chemistry.chemical_compound, In vivo, Sedative/hypnotic, medicine, Animals, Hypnotics and Sedatives, Computer Simulation, Sleeping pattern, Imidazoles, General Medicine, Experimental validation, Benzazepines, Rats, 030104 developmental biology, chemistry, Molecular Medicine, Alcaftadine, DrugBank, medicine.drug
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5
المؤلفون: Kimberley Hanson, Adam E. Hendry, Georgios Drakakis, Grant N. Wheeler, Andreas Bender, Suzanne C. Brewerton, David A. Evans, Michael J. Bodkin
المصدر: MedChemComm. 5:386-396
مصطلحات موضوعية: Pharmacology, biology, Drug discovery, In silico, Organic Chemistry, Decision tree, Xenopus, Pharmaceutical Science, Computational biology, biology.organism_classification, Bioinformatics, Biochemistry, Phenotype, Drug Discovery, Molecular Medicine, Identification (biology), Mode of action, Zebrafish
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6
المؤلفون: Andreas Bender, Mateusz Maciejewski, Georgios Drakakis, Robert C. Glen, Alexios Koutsoukas, Fazlin Mohd Fauzi, Ha P. Nguyen
المصدر: Chemical Biology & Drug Design. 82:252-266
مصطلحات موضوعية: Berberine Alkaloids, Biology, Biochemistry, Small Molecule Libraries, Set (abstract data type), Drug Discovery, Selection (genetic algorithm), Pharmacology, business.industry, Organic Chemistry, Fingerprint (computing), Computational Biology, Proteins, Sampling (statistics), Pattern recognition, Combinatorial chemistry, Chemical space, High-Throughput Screening Assays, Data set, Test set, Molecular Medicine, Artificial intelligence, business, Algorithms, Protein Binding, Diversity (business)
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7
المؤلفون: Thomas Exner, Roland Grafström, Ahmed Abdelaziz, Penny Nymark, Philip Doganis, Lucian Farcal, Barry Hardy, Charalampos Chomenidis, Georgia Tsiliki, Georgios Drakakis, Haralambos Sarimveis, Pekka Kohonen
مصطلحات موضوعية: Omics data, Computational model, Engineering, business.industry, Engineered nanomaterials, Alternatives to animal testing, Nanotechnology, Biochemical engineering, business
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8
المؤلفون: Siti Zuraidah Mohamad Zobir, Georgios Drakakis, Andreas Bender, Tai-Ping David Fan, Fazlin Mohd Fauzi, Xianjun Fu, Sonia Liggi
المساهمون: Liggi, Sonia [0000-0003-1802-357X], Drakakis, Georgios [0000-0002-6635-9273], Fan, Tai-Ping [0000-0003-1000-5369], Bender, Andreas [0000-0002-6683-7546], Apollo - University of Cambridge Repository
المصدر: Evidence-Based Complementary and Alternative Medicine, Vol 2016 (2016)
Evidence-based Complementary and Alternative Medicine : eCAMمصطلحات موضوعية: 0301 basic medicine, Biomedical, Therapeutic action, Protein family, Article Subject, In silico, lcsh:Other systems of medicine, Traditional Chinese medicine, Computational biology, Biology, lcsh:RZ201-999, 0601 Biochemistry and Cell Biology, Bioinformatics, Hierarchical clustering, 03 medical and health sciences, Annotation, Prediction algorithms, 030104 developmental biology, Basic Science, Complementary and alternative medicine, KEGG, Research Article
وصف الملف: text/xhtml; text/xml; application/pdf
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9
المؤلفون: Georgios Drakakis, Saadiq Moledina, Charalampos Chomenidis, Haralambos Sarimveis, Philip Doganis
المصدر: Combinatorial chemistryhigh throughput screening. 19(5)
مصطلحات موضوعية: 0301 basic medicine, Computer science, Decision tree, Datasets as Topic, computer.software_genre, Machine learning, 03 medical and health sciences, C4.5 algorithm, Drug Discovery, Medicine, Chinese Traditional, Categorical variable, Interpretability, Class (computer programming), business.industry, Conditional mutual information, Organic Chemistry, Decision Trees, General Medicine, Computer Science Applications, 030104 developmental biology, Pharmaceutical Preparations, Artificial intelligence, Data mining, business, Tweaking, computer, DrugBank, Algorithms
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10
المؤلفون: Lewis H. Mervin, Andreas Bender, Georgios Drakakis, Avid M. Afzal, Ola Engkvist, Richard J. Lewis
المساهمون: Mervin, Lewis [0000-0002-7271-0824], Drakakis, Georgios [0000-0002-6635-9273], Bender, Andreas [0000-0002-6683-7546], Apollo - University of Cambridge Repository
المصدر: Journal of Cheminformatics
مصطلحات موضوعية: Quantitative structure–activity relationship, Computer science, QSAR, Cheminformatics, Similarity search, Library and Information Sciences, chEMBL, computer.software_genre, Computer Graphics and Computer-Aided Design, BEDROC, Computer Science Applications, Data set, Naive Bayes classifier, Data point, Data mining, Physical and Theoretical Chemistry, Precision and recall, computer, Applicability domain, Research Article
وصف الملف: application/pdf
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11
المؤلفون: Christoph Helma, Roland Grafström, Pekka Kohonen, Egon Willighagen, Vesa Hongisto, Nikolay Kochev, Micha Rautenberg, Nina Jeliazkova, Linda Rieswijk, Charalampos Chomenidis, Bengt Fadeel, Penny Nymark, Georgios Drakakis, Haralambos Sarimveis, Gareth Owen, Denis Gebele, Barry Hardy, Georgia Tsiliki, G. Kilic, Lucian Farcal, Friederike Ehrhart, J. Chang, Philip Doganis
المصدر: Toxicology Letters. 258:S118-S119
مصطلحات موضوعية: Engineering, business.industry, General Medicine, Ontology (information science), Toxicology, business, Software engineering, nanomaterials
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12
المؤلفون: Sonia, Liggi, Georgios, Drakakis, Alexios, Koutsoukas, Isidro, Cortes-Ciriano, Patricia, Martínez-Alonso, Thérèse E, Malliavin, Adrian, Velazquez-Campoy, Suzanne C, Brewerton, Michael J, Bodkin, David A, Evans, Robert C, Glen, José Alberto, Carrodeguas, Andreas, Bender
المصدر: Future medicinal chemistry. 6(18)
مصطلحات موضوعية: Small Molecule Libraries, Mice, Stem Cells, Animals, Computational Biology, Apoptosis, Computer Simulation
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13
المؤلفون: Aakash Chavan, Ravindranath, Nolen, Perualila-Tan, Adetayo, Kasim, Georgios, Drakakis, Sonia, Liggi, Suzanne C, Brewerton, Daniel, Mason, Michael J, Bodkin, David A, Evans, Aditya, Bhagwat, Willem, Talloen, Hinrich W H, Göhlmann, Ziv, Shkedy, Andreas, Bender, Laure, Cougnaud
المصدر: Molecular bioSystems. 11(1)
مصطلحات موضوعية: Anti-Inflammatory Agents, Computational Biology, Antineoplastic Agents, Gene Expression Regulation, Cell Line, Tumor, Databases, Genetic, Drug Discovery, Cluster Analysis, Humans, Hypoglycemic Agents, Computer Simulation, Gene Regulatory Networks, Transcriptome, Algorithms, Antipsychotic Agents, Signal Transduction
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14
المؤلفون: Andreas Bender, Michael J. Bodkin, Georgios Drakakis, David A. Evans, Alexios Koutsoukas, Suzanne C. Brewerton
المصدر: Combinatorial chemistryhigh throughput screening. 18(3)
مصطلحات موضوعية: Computer science, In silico, Scale (descriptive set theory), computer.software_genre, Ligands, Small Molecule Libraries, Naive Bayes classifier, Bayes' theorem, Similarity (network science), Drug Discovery, Humans, business.industry, Organic Chemistry, Proteins, Pattern recognition, Bayes Theorem, General Medicine, chEMBL, Chemical space, Computer Science Applications, Metric (mathematics), Artificial intelligence, Data mining, business, computer, Algorithms
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15
المؤلفون: Georgios Drakakis, Andreas Bender, David A. Evans, Grant N. Wheeler, Michael J. Bodkin, Adam E. Hendry, Suzanne C. Brewerton, Sonia Liggi, Kimberley Hanson
المصدر: Molecular informatics. 32(11-12)
مصطلحات موضوعية: Biological data, Systems biology, In silico, Organic Chemistry, Xenopus, Biology, Pharmacology, Complex network, biology.organism_classification, Small molecule, Computer Science Applications, Structural Biology, Cheminformatics, Drug Discovery, Molecular Medicine, Genetic screen
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16
المؤلفون: Georgios Drakakis, Suzanne C. Brewerton, Andreas Bender, Alexios Koutsoukas, David De Evans
المساهمون: Drakakis, Georgios [0000-0002-6635-9273], Apollo - University of Cambridge Repository
المصدر: Journal of Cheminformatics
مصطلحات موضوعية: Sleeping pattern, 3403 Macromolecular and Materials Chemistry, 34 Chemical Sciences, Computer science, business.industry, Phenotypic screening, Rat model, Library and Information Sciences, Machine learning, computer.software_genre, Computer Graphics and Computer-Aided Design, Computer Science Applications, Action (philosophy), 3401 Analytical Chemistry, Poster Presentation, Data mining, Artificial intelligence, Polypharmacology, Physical and Theoretical Chemistry, business, computer
وصف الملف: text/xml; application/pdf
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17
المساهمون: Drakakis, George [0000-0002-6635-9273], Apollo - University of Cambridge Repository
المصدر: Journal of Cheminformatics
مصطلحات موضوعية: 3403 Macromolecular and Materials Chemistry, 34 Chemical Sciences, business.industry, Ligand, Chemical similarity, Computational biology, Library and Information Sciences, Space (commercial competition), computer.software_genre, chEMBL, Computer Graphics and Computer-Aided Design, Chemical space, Computer Science Applications, 3401 Analytical Chemistry, Similarity (psychology), Poster Presentation, Medicine, Drug side effects, Data mining, Physical and Theoretical Chemistry, business, computer, G protein-coupled receptor
وصف الملف: text/xml; application/pdf
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18
المصدر: Current Protocols in Chemical Biology
مصطلحات موضوعية: 0301 basic medicine, Databases, Factual, business.industry, Computer science, Drug candidate, General Medicine, 010402 general chemistry, Machine learning, computer.software_genre, chEMBL, 01 natural sciences, 0104 chemical sciences, Machine Learning, Small Molecule Libraries, Inhibitory Concentration 50, 03 medical and health sciences, 030104 developmental biology, Pharmaceutical Preparations, Mechanism of action, medicine, Artificial intelligence, Polypharmacology, medicine.symptom, business, computer
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19
المؤلفون: Georgios Drakakis, Moledina S, Chomenidis C, Doganis P, Sarimveis H
المصدر: Europe PubMed Central