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1دورية أكاديمية
المؤلفون: Warszycki, Dawid, Rueda, Manuel, Mordalski, Stefan, Kristiansen, Kurt, Satała, Grzegorz, Rataj, Krzysztof, Chilmonczyk, Zdzisław, Sylte, Ingebrigt, Abagyan, Ruben, Bojarski, Andrzej J
المصدر: Journal of Chemical Information and Modeling. 57(2)
مصطلحات موضوعية: Generic health relevance, Crystallography, X-Ray, Drug Evaluation, Preclinical, HEK293 Cells, Humans, Ligands, Molecular Docking Simulation, Monte Carlo Method, Protein Binding, Protein Conformation, Receptor, Serotonin, 5-HT1A, Structural Homology, Protein, Medicinal and Biomolecular Chemistry, Theoretical and Computational Chemistry, Computation Theory and Mathematics, Medicinal & Biomolecular Chemistry
وصف الملف: application/pdf
الوصول الحر: https://escholarship.org/uc/item/1m0398tjTest
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2
المؤلفون: Wenli Wang, Weiqing Peng, Chen Zhu, Wei Li, Wei Fu, Bing Han, Lan Zheng
المصدر: Journal of Chemical Information and Modeling. 60:235-248
مصطلحات موضوعية: Indole test, Agonist, 010304 chemical physics, medicine.drug_class, Stereochemistry, General Chemical Engineering, General Chemistry, Library and Information Sciences, 01 natural sciences, 0104 chemical sciences, Computer Science Applications, 010404 medicinal & biomolecular chemistry, chemistry.chemical_compound, chemistry, Amide, 0103 physical sciences, medicine, Structure–activity relationship, 5-HT1A receptor, Selectivity, Receptor, 5-HT receptor
الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_________::14db8c9c5092cccc3cd4004b7f8d53c0Test
https://doi.org/10.1021/acs.jcim.9b00926Test -
3
المؤلفون: Dawid Warszycki, Ruben Abagyan, Grzegorz Satała, Zdzisław Chilmonczyk, Kurt Kristiansen, Stefan Mordalski, Krzysztof Rataj, Andrzej J. Bojarski, Ingebrigt Sylte, Manuel Rueda
المصدر: Journal of Chemical Information and Modeling. 57:311-321
مصطلحات موضوعية: 0301 basic medicine, Protein Conformation, Stereochemistry, General Chemical Engineering, Drug Evaluation, Preclinical, Computational biology, Library and Information Sciences, Biology, Crystallography, X-Ray, Ligands, Article, 03 medical and health sciences, Serotonin 1A Receptor, Humans, General Chemistry, Computer Science Applications, Molecular Docking Simulation, HEK293 Cells, 030104 developmental biology, Template, Structural Homology, Protein, Docking (molecular), Receptor, Serotonin, 5-HT1A, 5-HT1A receptor, Monte Carlo Method, Protein Binding
الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::fb54efd1629151ace84c6ce1977c30c0Test
https://doi.org/10.1021/acs.jcim.6b00263Test -
4
المؤلفون: Jean-François Liégeois, Sébastien Dilly
المصدر: Journal of Chemical Information and Modeling. 56:1324-1331
مصطلحات موضوعية: Models, Molecular, 0301 basic medicine, Molecular model, Protein Conformation, Pyridines, Stereochemistry, General Chemical Engineering, In silico, Mutant, Context (language use), Chemistry Techniques, Synthetic, Spodoptera, Library and Information Sciences, Ligands, Piperazines, Substrate Specificity, 03 medical and health sciences, Sf9 Cells, Animals, Humans, Receptor, Chemistry, Hydrogen bond, Receptors, Dopamine D4, General Chemistry, Combinatorial chemistry, Computer Science Applications, Molecular Docking Simulation, 030104 developmental biology, Dopamine receptor, Mutation, Receptor, Serotonin, 5-HT1A, Selectivity, Protein Binding
الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::ab3d728f63fdddddac6e1aacba79bfdfTest
https://doi.org/10.1021/acs.jcim.5b00753Test -
5
المؤلفون: Alexander Golbraikh, Alexander Tropsha, Man Luo, Bryan L. Roth, Xiang Simon Wang
المصدر: Journal of Chemical Information and Modeling
مصطلحات موضوعية: Virtual screening, Quantitative structure–activity relationship, General Chemical Engineering, Drug Evaluation, Preclinical, Quantitative Structure-Activity Relationship, General Chemistry, Plasma protein binding, Computational biology, Library and Information Sciences, Biology, Ligands, Combinatorial chemistry, Article, Computer Science Applications, User-Computer Interface, chemistry.chemical_compound, Lysergol, chemistry, Active compound, Receptor, Serotonin, 5-HT1A, Diversity Library, 5-HT1A receptor, Antipsychotic Agents, Protein Binding, G protein-coupled receptor
الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::a0a5f70cdc5eca238b45bcece2712b98Test
https://doi.org/10.1021/ci400460qTest -
6
المصدر: Journal of Chemical Information and Modeling. 51:2961-2966
مصطلحات موضوعية: Male, Agonist, Turkeys, Molecular model, medicine.drug_class, Stereochemistry, General Chemical Engineering, Action Potentials, Carboxamide, Library and Information Sciences, Crystallography, X-Ray, Piperazines, Inhibitory Concentration 50, Structure-Activity Relationship, chemistry.chemical_compound, Amide, medicine, Animals, Humans, Computer Simulation, Rats, Wistar, Binding site, Chemistry, Microtomy, General Chemistry, Amides, Rats, Serotonin Receptor Agonists, Computer Science Applications, Kinetics, Piperazine, Docking (molecular), Receptor, Serotonin, 5-HT1A, Sequence Alignment, Linker, Brain Stem, Serotonergic Neurons
الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::399f4b1cb13cfb4f8a060f5ac0ee6f2eTest
https://doi.org/10.1021/ci200313rTest -
7
المؤلفون: Peng Lian, LinLang Li, Chuanrong Geng, Wei Fu, Xuechu Zhen
المصدر: Journal of chemical information and modeling. 55(8)
مصطلحات موضوعية: Models, Molecular, Flexibility (anatomy), Binding Sites, Stereochemistry, Chemistry, Receptors, Dopamine D2, General Chemical Engineering, Receptors, Dopamine D1, General Chemistry, Library and Information Sciences, Serotonin 5-HT1 Receptor Agonists, Computer Science Applications, Molecular dynamics, chemistry.chemical_compound, medicine.anatomical_structure, Drug Design, Receptor, Serotonin, 5-HT1A, medicine, Computational design, Humans, Receptor, Serotonin, 5-HT2A, Binding site, Lead compound, Neurological problems, Binding affinities
الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::42b7cbc1bed5f692e5812a63b26d2addTest
https://pubmed.ncbi.nlm.nih.gov/26131601Test -
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المؤلفون: Yoshimasa Takahashi, Naoya Nagata, Kentaro Kawai
المصدر: Journal of chemical information and modeling. 54(1)
مصطلحات موضوعية: Receptor, Adenosine A2A, Stereochemistry, Databases, Pharmaceutical, General Chemical Engineering, Quantitative Structure-Activity Relationship, Library and Information Sciences, Ligands, Fragment (logic), Drug Discovery, Side chain, Molecule, Animals, Humans, Computer Simulation, Molecular Structure, Chemistry, Computational Biology, General Chemistry, Chemical space, Computer Science Applications, Rats, Models, Chemical, Drug Design, Mutation (genetic algorithm), Mutation, Receptor, Serotonin, 5-HT1A, Directed Molecular Evolution, Algorithms
الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::97e1f7e331eeaa87d39595b4248fffc2Test
https://pubmed.ncbi.nlm.nih.gov/24372539Test -
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المؤلفون: Bo Gao, Xuechu Zhen, Wei Fu, Kunqian Yu, Hualiang Jiang, Shanglin Zhou, Lili Xu
المصدر: Journal of chemical information and modeling. 53(12)
مصطلحات موضوعية: Agonist, Indoles, Molecular model, medicine.drug_class, General Chemical Engineering, Protein Data Bank (RCSB PDB), Computational biology, Library and Information Sciences, Molecular Dynamics Simulation, Ligands, Molecular Docking Simulation, Piperazines, Small Molecule Libraries, Structure-Activity Relationship, User-Computer Interface, Catalytic Domain, Drug Discovery, medicine, Humans, Homology modeling, Databases, Protein, Virtual screening, Drug discovery, Chemistry, General Chemistry, Serotonin 5-HT1 Receptor Agonists, Combinatorial chemistry, Computer Science Applications, High-Throughput Screening Assays, Guanosine 5'-O-(3-Thiotriphosphate), Structural Homology, Protein, Receptor, Serotonin, 5-HT1A, Receptors, Adrenergic, beta-2, Pharmacophore, Protein Binding
الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::fa8eb1df046e6abdc42189fe60522fdfTest
https://pubmed.ncbi.nlm.nih.gov/24245825Test -
10
المؤلفون: Ye Hu, Jürgen Bajorath
المصدر: Journal of chemical information and modeling. 53(3)
مصطلحات موضوعية: Serotonin Plasma Membrane Transport Proteins, Receptor, Adenosine A2A, Chemistry, General Chemical Engineering, Receptors, Drug, Receptor, Adenosine A3, General Chemistry, Library and Information Sciences, Small molecule, Combinatorial chemistry, Nociceptin Receptor, Computer Science Applications, Substrate Specificity, Small Molecule Libraries, Structure-Activity Relationship, Cytochrome P-450 Enzyme System, Drug Design, Receptors, Opioid, delta, Receptor, Serotonin, 5-HT1A, Receptors, Opioid, Cytochrome P-450 Enzyme Inhibitors, Enzyme Inhibitors, Selectivity
الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::b8c3e07600748ed5e7c883d000d8802aTest
https://pubmed.ncbi.nlm.nih.gov/23379346Test