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1دورية أكاديمية
المؤلفون: Denis Schmidt, Magdalena M. Scharf, Dominique Sydow, Eva Aßmann, Maria Martí-Solano, Marina Keul, Andrea Volkamer, Peter Kolb
المصدر: Molecules, Vol 26, Iss 3, p 629 (2021)
مصطلحات موضوعية: multi-target ligands, docking, chemoinformatics, bioinformatics, kinases, binding site comparison, Organic chemistry, QD241-441
وصف الملف: electronic resource
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2
المؤلفون: Andreas Heine, Gerhard Klebe, B. Wienen-Schmidt, Holger Gohlke, Denis Schmidt, Hans-Dieter Gerber
المصدر: ACS Chemical Biology. 14:2585-2594
مصطلحات موضوعية: 0301 basic medicine, Drug, media_common.quotation_subject, Context (language use), Calorimetry, Molecular Dynamics Simulation, Crystallography, X-Ray, Ligands, Methylation, 01 natural sciences, Biochemistry, 03 medical and health sciences, chemistry.chemical_compound, Computational chemistry, media_common, 010405 organic chemistry, Chemistry, Kinase, Isothermal titration calorimetry, General Medicine, Ligand (biochemistry), 0104 chemical sciences, 030104 developmental biology, Pharmaceutical Preparations, Non additivity, Molecular Medicine, Protein Kinases, Protein Binding, Methyl group
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3
المؤلفون: Jillian G. Baker, Jakub Gunera, Denis Schmidt, Peter Kolb
المصدر: ACS Medicinal Chemistry Letters. 8:481-485
مصطلحات موضوعية: 0301 basic medicine, Stereochemistry, Ligand, Organic Chemistry, Biology, Biochemistry, β2 adrenergic receptor, 03 medical and health sciences, 030104 developmental biology, Docking (molecular), Drug Discovery, Molecule, Substructure, Receptor, G protein-coupled receptor
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4
المؤلفون: Christopher Pfleger, Denis Schmidt, Holger Gohlke, Jonas Dittrich
المصدر: Journal of chemical information and modeling 59(1), 509–521 (2019). doi:10.1021/acs.jcim.8b00582
مصطلحات موضوعية: Training set, Theoretical computer science, 010304 chemical physics, Computer science, General Chemical Engineering, General Chemistry, Library and Information Sciences, 01 natural sciences, 0104 chemical sciences, Computer Science Applications, 010404 medicinal & biomolecular chemistry, Formalism (philosophy of mathematics), 0103 physical sciences, ddc:540
URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::69400a0e61a3f5eee3384b19bf4cae82
https://juser.fz-juelich.de/record/858302 -
5
المصدر: Journal of chemical theory and computation 15(5), 3331–3343 (2019). doi:10.1021/acs.jctc.8b01295
مصطلحات موضوعية: Drug, 010304 chemical physics, Molecular Structure, media_common.quotation_subject, Sampling (statistics), Proteins, Computational biology, Biology, Molecular Dynamics Simulation, Ligands, 01 natural sciences, Computer Science Applications, Drug Design, 0103 physical sciences, Structure based, Identification (biology), Protein activity, ddc:610, Physical and Theoretical Chemistry, Binding site, media_common
URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::33970944e93124d36ae99a9e89b5c94f
https://hdl.handle.net/2128/22180 -
6
المؤلفون: Jonas, Dittrich, Denis, Schmidt, Christopher, Pfleger, Holger, Gohlke
المصدر: Journal of chemical information and modeling. 59(1)
مصطلحات موضوعية: Models, Molecular, Informatics, Drug Design, Knowledge Bases, Ligands
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7
المؤلفون: Jana Selent, Denis Schmidt, Maria Marti-Solano, Peter Kolb
المصدر: Drug Discovery Today. 21:625-631
مصطلحات موضوعية: 0301 basic medicine, Pharmacology, Protein Conformation, Nanotechnology, Context (language use), Computational biology, Molecular Dynamics Simulation, Biology, Receptors, G-Protein-Coupled, 03 medical and health sciences, 030104 developmental biology, 0302 clinical medicine, Drug development, Structural biology, Drug Design, Drug Discovery, 030217 neurology & neurosurgery, G protein-coupled receptor
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8
المؤلفون: D. Timoteo, Ewerton Dilelis Ferreira, Orlando Fernández Aquino, T. Silva, G. Espínola, Josué Denis Schmidt, Daniel Brandão, E. V. da Silva, I. Pedreira, D. Oshiro
المصدر: Revista Científica Estudios e Investigaciones. 8:95
مصطلحات موضوعية: business.industry, Medicine, General Medicine, business, Humanities
URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_________::34b8c22092e9ab6e3b9b4002d3050071
https://doi.org/10.26885/rcei.foro.2019.95 -
9Identifying Modulators of CXC Receptors 3 and 4 with Tailored Selectivity Using Multi-Target Docking
المؤلفون: Regine Brox, Denis Schmidt, Peter Kolb, Nuska Tschammer, Viachaslau Bernat
المصدر: ACS Chemical Biology. 10:715-724
مصطلحات موضوعية: Receptors, CXCR4, Receptors, CXCR3, Computational biology, Pharmacology, Biology, Ligands, Sulfur Radioisotopes, CXCR3, Biochemistry, Molecular Docking Simulation, Protein Structure, Secondary, Small Molecule Libraries, Structure-Activity Relationship, Chemokine receptor, Drug Discovery, Humans, Homology modeling, Binding site, Receptor, Binding Sites, Drug discovery, Cell Membrane, General Medicine, Protein Structure, Tertiary, HEK293 Cells, Guanosine 5'-O-(3-Thiotriphosphate), Structural Homology, Protein, Docking (molecular), Molecular Medicine, Databases, Chemical, Protein Binding
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10
المؤلفون: Denis, Schmidt, Jakub, Gunera, Jillian G, Baker, Peter, Kolb
المصدر: ACS medicinal chemistry letters. 8(5)