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1دورية أكاديمية
المؤلفون: Larisa Ivanova, Mati Karelson, Dimitar A. Dobchev
المصدر: Molecules, Vol 25, Iss 8, p 1846 (2020)
مصطلحات موضوعية: Alzheimer’s disease, molecular docking, molecular dynamics, QSAR, neural networks, CADD, Organic chemistry, QD241-441
وصف الملف: electronic resource
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2دورية أكاديمية
المؤلفون: Larisa Ivanova, Mati Karelson, Dimitar A. Dobchev
المصدر: Molecules, Vol 23, Iss 8, p 1847 (2018)
مصطلحات موضوعية: natural compounds, artificial neural networks, molecular docking, TrkA, NMDA, LRRK2, molecular dynamics, CADD, Organic chemistry, QD241-441
وصف الملف: electronic resource
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3
المؤلفون: Dimitar A Dobchev, Larisa Ivanova, Mati Karelson
المصدر: Molecules, Vol 25, Iss 1846, p 1846 (2020)
Molecules
Volume 25
Issue 8مصطلحات موضوعية: Drug, Quantitative structure–activity relationship, media_common.quotation_subject, Quantitative Structure-Activity Relationship, Pharmaceutical Science, Disease, Computational biology, Molecular Dynamics Simulation, Article, Workflow, Analytical Chemistry, lcsh:QD241-441, 03 medical and health sciences, 0302 clinical medicine, Experimental testing, multifunctional drugs, lcsh:Organic chemistry, Drug Discovery, CADD, Aspartic Acid Endopeptidases, Humans, Medicine, Physical and Theoretical Chemistry, 030304 developmental biology, media_common, 0303 health sciences, Virtual screening, Binding Sites, Glycogen Synthase Kinase 3 beta, Molecular Structure, Drug candidate, business.industry, QSAR, Organic Chemistry, Human brain, molecular docking, neural networks, molecular dynamics, Molecular Docking Simulation, medicine.anatomical_structure, Chemistry (miscellaneous), Acetylcholinesterase, Molecular Medicine, Amyloid Precursor Protein Secretases, business, Alzheimer’s disease, 030217 neurology & neurosurgery, Protein Binding
وصف الملف: application/pdf
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4Have artificial neural networks met expectations in drug discovery as implemented in QSAR framework?
المؤلفون: Dimitar A. Dobchev, Mati Karelson
المصدر: Expert Opinion on Drug Discovery. 11:627-639
مصطلحات موضوعية: 0301 basic medicine, Quantitative structure–activity relationship, Process (engineering), Computer science, Quantitative Structure-Activity Relationship, 01 natural sciences, 03 medical and health sciences, Drug Discovery, Animals, Humans, Interpretability, Artificial neural network, business.industry, Management science, Drug discovery, Models, Theoretical, 0104 chemical sciences, 010404 medicinal & biomolecular chemistry, 030104 developmental biology, Nonlinear Dynamics, Pharmaceutical Preparations, Drug Design, Neural Networks, Computer, Artificial intelligence, business, Medical science, Algorithms
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5
المؤلفون: Mattias Hällbrink, Ülo Langel, Mati Karelson, Dimitar A. Dobchev, Jakob Regberg, Moataz Dowaidar, Tõnis Lehto
مصطلحات موضوعية: 0301 basic medicine, Quantitative structure–activity relationship, Bioengineering, Peptide, 02 engineering and technology, Computational biology, Biochemistry, Molecular mechanics, PBTS, Analytical Chemistry, 03 medical and health sciences, Drug Discovery, chemistry.chemical_classification, Cell penetrating peptides, Oligonucleotide, QSAR, Biochemistry and Molecular Biology, Peptide based transfection systems, Biological activity, Transfection, Kemi, 021001 nanoscience & nanotechnology, Combinatorial chemistry, 030104 developmental biology, chemistry, Drug delivery, Chemical Sciences, Cell-penetrating peptide, Molecular Medicine, fragmentatio, 0210 nano-technology, AMBER, CPP, Biokemi och molekylärbiologi
URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::45fd0dbdece75872eb33554086deaf1c
http://urn.kb.se/resolve?urn=urn:nbn:se:su:diva-140132 -
6
المؤلفون: Dimitar A. Dobchev, Mati Karelson
مصطلحات موضوعية: Multilinear map, Quantitative structure–activity relationship, Artificial neural network, 010405 organic chemistry, Chemistry, Stereochemistry, business.industry, Pattern recognition, 01 natural sciences, Regression, 0104 chemical sciences, 010404 medicinal & biomolecular chemistry, Molecular descriptor, Linear regression, Principal component analysis, Statistical analysis, Artificial intelligence, business
URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_________::f1a31d2272b340edb5854309498eeec3
https://doi.org/10.1016/bs.aihch.2016.03.006 -
7
المؤلفون: Mati Karelson, Dimitar A. Dobchev
المصدر: Expert Opinion on Drug Discovery. 6:783-796
مصطلحات موضوعية: body regions, Cell membrane permeability, Artificial neural network, business.industry, Computer science, Expert opinion, Drug Discovery, Artificial intelligence, equipment and supplies, business, Cell penetration, Gastrointestinal absorption
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8
المؤلفون: Alan R. Katritzky, Zuoquan Wang, Svetoslav Slavov, Dimitar A. Dobchev, C. Dennis Hall, Maia Tsikolia, Ulrich R. Bernier, Natasha M. Elejalde, Gary G. Clark, Kenneth J. Linthicum
المصدر: Journal of Medical Entomology. 47:924-938
مصطلحات موضوعية: Infectious Diseases, General Veterinary, Insect Science, Parasitology
URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_________::46f832b1654137d0d5e5f6c261f451c3
https://doi.org/10.1093/jmedent/47.5.924 -
9
المؤلفون: Indrek Tulp, Dimitar A. Dobchev, Uko Maran, William E. Acree, Alan R. Katritzky
المصدر: Journal of Chemical Information and Modeling. 50:1275-1283
مصطلحات موضوعية: Principal Component Analysis, Chromatography, Polarity (physics), Chemistry, General Chemical Engineering, Chemical structure, Quantitative Structure-Activity Relationship, Thermodynamics, General Chemistry, Library and Information Sciences, Electrostatics, Acceptor, Data matrix (multivariate statistics), Computer Science Applications, Solubility, Molecular size, Principal component analysis, Solvents
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10
المؤلفون: Liliana M. Pacureanu, Alan R. Katritzky, Svetoslav Slavov, Dimitar A. Dobchev, Dinesh O. Shah, Mati Karelson
المصدر: Computers & Chemical Engineering. 33:321-332
مصطلحات موضوعية: Multilinear map, chemistry.chemical_compound, Quantitative structure–activity relationship, Pulmonary surfactant, Chemistry, Computational chemistry, General Chemical Engineering, Polymer chemistry, Cationic polymerization, Pyridinium, Micelle, Computer Science Applications