المؤلفون: Arteaga, Ana, Arino, Trevor, Moore, Guy C, Bustos, Jenna L, Horton, Matthew K, Persson, Kristin A, Li, Jun, Stickle, William F, Kohlgruber, Tsuyoshi A, Surbella, Robert G, Nyman, May

المصدر: Chemistry - A European Journal. 30(27)

مصطلحات موضوعية: Inorganic Chemistry, Chemical Sciences, uranyl, peroxide, alkalis, SAXS, X-ray structure, CO2 direct air capture, MSD-General, MSD-Materials Project, General Chemistry, Chemical sciences

وصف الملف: application/pdf

URL الوصول: https://escholarship.org/uc/item/2z72r0n8
https://escholarship.org/content/qt2z72r0n8/qt2z72r0n8.pdf

المؤلفون: Natalia Prusinowska, Agnieszka Czapik, Joanna Szymkowiak, Marcin Kwit

المصدر: Scientific Reports, Vol 15, Iss 1, Pp 1-18 (2025)

مصطلحات موضوعية: Macrocycle, Chirality, Sulfur-containing compounds, Polyimine, Circular dichroism, X-ray structure, Medicine, Science

وصف الملف: electronic resource

Relation: https://doaj.org/toc/2045-2322

URL الوصول: https://doaj.org/article/184097d81d0144da8e1f66f124fa0b93

المؤلفون: Bronte Carr, Timothy D. Christopher, Tilo Söhnel, Lawrence R. Gahan, Cassandra L. Fleming, Allan G. Blackman

المصدر: ChemistryOpen, Vol 14, Iss 1, Pp n/a-n/a (2025)

مصطلحات موضوعية: Tripodal, Quinoline, X-ray structure, Dimer, Calculations, Chemistry, QD1-999

وصف الملف: electronic resource

Relation: https://doaj.org/toc/2191-1363

URL الوصول: https://doaj.org/article/3dbb72ad79064a6bab742978b652e471

المؤلفون: Ayoup, Mohammed Salah, Yasser, Mennatallah, Soliman, Saied M., Abdel-Hamid, Hamida, Cordes, David Bradford, McKay, Aidan, Ghareeb, Doaa A., Ashraf, Samah, Yousri, Amal

المساهمون: University of St Andrews.School of Chemistry, University of St Andrews.EaSTCHEM

مصطلحات موضوعية: Sulfonamide, Copper, Oxalate, X-ray structure, Hirshfeld analysis, Antidiabetic, RR-NDAS, SDG 3 - Good Health and Well-being

وصف الملف: application/pdf

Relation: Journal of Molecular Structure (Theochem); 311968674; 85212836098; https://hdl.handle.net/10023/31116

الاتاحة: https://hdl.handle.net/10023/31116
https://doi.org/10.1016/j.molstruc.2024.141067

المؤلفون: R. Alan Aitken, Alexander J. B. Nelson, Alexandra M. Z. Slawin

المصدر: Molbank, Vol 2024, Iss 4, p M1939 (2024)

مصطلحات موضوعية: X-ray structure, NMR spectra, Inorganic chemistry, QD146-197

وصف الملف: electronic resource

Relation: https://www.mdpi.com/1422-8599/2024/4/M1939; https://doaj.org/toc/1422-8599

URL الوصول: https://doaj.org/article/ca43212dd14745f1861b73e024bb90fd

المؤلفون: Marta Ilona Wojtyś, Weronika Maksymiuk, Marta Narczyk, Ante Bubić, Ivana Leščić Ašler, Paweł Krzyżek, Grażyna Gościniak, Elżbieta Katarzyna Jagusztyn-Krynicka, Agnieszka Bzowska

المصدر: Journal of Enzyme Inhibition and Medicinal Chemistry, Vol 39, Iss 1 (2024)

مصطلحات موضوعية: Adenylosuccinate synthetase, Helicobacter pylori, vitamin B6, antimicrobial activity, X-ray structure, Therapeutics. Pharmacology, RM1-950

وصف الملف: electronic resource

Relation: https://doaj.org/toc/1475-6366; https://doaj.org/toc/1475-6374

URL الوصول: https://doaj.org/article/d49a28023d5d4282a32dff07929d534e

المؤلفون: Daniele Veggi, Chelsy C. Chesterman, Laura Santini, Ying Huang, Nicola Pacchiani, Jeannette Sierra, Lynn Chen, Jason Laliberte, Federica Bianchi, Roberta Cozzi, Elisabetta Frigimelica, Domenico Maione, Oretta Finco, Matthew J. Bottomley

المصدر: FASEB BioAdvances, Vol 6, Iss 8, Pp 235-248 (2024)

مصطلحات موضوعية: antibody specificity, factor‐H binding protein, meningococcus, serum bactericidal assay, vaccine, x‐ray structure, Biology (General), QH301-705.5

وصف الملف: electronic resource

Relation: https://doaj.org/toc/2573-9832

URL الوصول: https://doaj.org/article/9b599c9365e449dfb0b143e66a3cfe14

المؤلفون: Mohamed El-Naggar, Kamrul Hasan, Monther A. Khanfar, Fatima-Azzahra Delmani, Ihsan A. Shehadi, Raed Al-Qawasmeh, Hussein M. Elmehdi

المصدر: Heliyon, Vol 10, Iss 22, Pp e40318- (2024)

مصطلحات موضوعية: 1,2,3-Triazole, Pyridine, X-ray structure, Hirshfeld analysis, And DFT, Science (General), Q1-390, Social sciences (General), H1-99

وصف الملف: electronic resource

Relation: http://www.sciencedirect.com/science/article/pii/S2405844024163499; https://doaj.org/toc/2405-8440

URL الوصول: https://doaj.org/article/ce14e4065d5a46d08da53c36ec6028c8

المؤلفون: Majid Motevalli, Isaac Abrahams, Peter Blakskjær, Caroline E. Wyatt, Peter B. Wyatt

المصدر: Molbank, Vol 2024, Iss 4, p M1888 (2024)

مصطلحات موضوعية: X-ray structure, amino phosphonic acid, hydrogen bonding, Inorganic chemistry, QD146-197

وصف الملف: electronic resource

Relation: https://www.mdpi.com/1422-8599/2024/4/M1888; https://doaj.org/toc/1422-8599

URL الوصول: https://doaj.org/article/0401c989ce334a6ab6e94b425b175c81

المؤلفون: R. Alan Aitken, David B. Cordes, Lauryne Cottineau, Aidan P. McKay

المصدر: Molbank, Vol 2024, Iss 4, p M1891 (2024)

مصطلحات موضوعية: 1,3-benzoxathiole-2-thione, X-ray structure, NMR spectra, Inorganic chemistry, QD146-197

وصف الملف: electronic resource

Relation: https://www.mdpi.com/1422-8599/2024/4/M1891; https://doaj.org/toc/1422-8599

URL الوصول: https://doaj.org/article/5474a98069a7417cbfc9d3da6a0a762c

المؤلفون: R. Alan Aitken, David B. Cordes, Mhairi R. Kinahan, Aidan P. McKay

المصدر: Molbank, Vol 2024, Iss 3, p M1878 (2024)

مصطلحات موضوعية: X-ray structure, NMR spectra, Inorganic chemistry, QD146-197

وصف الملف: electronic resource

Relation: https://www.mdpi.com/1422-8599/2024/3/M1878; https://doaj.org/toc/1422-8599

URL الوصول: https://doaj.org/article/6a204a415e464552ac79072bacb8edc9

المؤلفون: Zsuzsanna Szalai, Anna Sára Kis, Angéla Takács, László Kőhidai, Konstantin Karaghiosoff, Mátyás Czugler, László Drahos, György Keglevich

المصدر: Molecules, Vol 30, Iss 2, p 428 (2025)

مصطلحات موضوعية: α-hydroxy-alkylphosphonates, Pudovik reaction, acylation, sulfonylation, Arbuzov reaction, X-ray structure, Organic chemistry, QD241-441

وصف الملف: electronic resource

Relation: https://www.mdpi.com/1420-3049/30/2/428; https://doaj.org/toc/1420-3049

URL الوصول: https://doaj.org/article/059cd8497fbb4884980898b0142e5bc3

المؤلفون: Zsuzsanna Szalai, Janka Bednárik, Boldizsár Szigfrid Tóth, Angéla Takács, Szilárd Tekula, László Kőhidai, Konstantin Karaghiosoff, László Drahos, György Keglevich

المصدر: Pharmaceuticals, Vol 18, Iss 1, p 91 (2025)

مصطلحات موضوعية: bisphosphonates, dronates, Arbuzov reaction, Pudovik reaction, X-ray structure, biological activity, Medicine, Pharmacy and materia medica, RS1-441

وصف الملف: electronic resource

Relation: https://www.mdpi.com/1424-8247/18/1/91; https://doaj.org/toc/1424-8247

URL الوصول: https://doaj.org/article/22aaac3011194b17be1428f57e2fd104

المؤلفون: Juha Mikko Rautiainen, Arto Valkonen, Jan Lundell, Kari Rissanen, Rakesh Puttreddy

المصدر: Advanced Science, Vol 11, Iss 30, Pp n/a-n/a (2024)

مصطلحات موضوعية: halogen bond, N‐oxide, perfluoroiodobenzene, sigma hole, X‐ray structure, Science

وصف الملف: electronic resource

Relation: https://doaj.org/toc/2198-3844

URL الوصول: https://doaj.org/article/6d355d713bdc4c0ebdac92f8f8ec0289

المؤلفون: Zhengjie He, Sergey Lindeman, William A. Donaldson

المصدر: Molbank, Vol 2024, Iss 3, p M1860 (2024)

مصطلحات موضوعية: X-ray structure, 2,4-dinitrophenylhydrazone, Inorganic chemistry, QD146-197

وصف الملف: electronic resource

Relation: https://www.mdpi.com/1422-8599/2024/3/M1860; https://doaj.org/toc/1422-8599

URL الوصول: https://doaj.org/article/05e8e8ad8893493e847558f8e7f92415

المؤلفون: Ashley L. Dey, Majid Motevalli, Isaac Abrahams, Peter B. Wyatt

المصدر: Molbank, Vol 2024, Iss 2, p M1835 (2024)

مصطلحات موضوعية: X-ray structure, imidazolidine-2-one, amino acid, urea, phosgene, Inorganic chemistry, QD146-197

وصف الملف: electronic resource

Relation: https://www.mdpi.com/1422-8599/2024/2/M1835; https://doaj.org/toc/1422-8599

URL الوصول: https://doaj.org/article/5d2cba90480e4b52a612fdc9fe0a084a

المؤلفون: R. Alan Aitken, Khadija Ait Moulay, David B. Cordes, Ryan A. Inwood, Fraser G. Jamieson, Alexander J. B. Nelson, Aidan P. McKay

المصدر: Organics, Vol 5, Iss 1, Pp 12-31 (2024)

مصطلحات موضوعية: 1,3-dihydrobenzo[d][1,3]oxaphosphole, 1,3-benzoxaphosphole, phosphonamidate, X-ray structure, hydrogen bonding, Organic chemistry, QD241-441

وصف الملف: electronic resource

Relation: https://www.mdpi.com/2673-401X/5/1/2; https://doaj.org/toc/2673-401X

URL الوصول: https://doaj.org/article/7bb160c7549e4946872a87e08bc3ca0e

المؤلفون: R. Alan Aitken, David B. Cordes, Arun Goyal, Aidan P. McKay

المصدر: Molbank, Vol 2024, Iss 2, p M1803 (2024)

مصطلحات موضوعية: X-ray structure, NMR spectra, Inorganic chemistry, QD146-197

وصف الملف: electronic resource

Relation: https://www.mdpi.com/1422-8599/2024/2/M1803; https://doaj.org/toc/1422-8599

URL الوصول: https://doaj.org/article/2b22e912fac64ecb8453224ff48d28f7

المؤلفون: López Muñoz, Laura

المساهمون: University/Department: Universitat Pompeu Fabra. Departament de Ciències Experimentals i de la Salut

Thesis Advisors: Pastor Maeso, Manuel

المصدر: TDX (Tesis Doctorals en Xarxa)

مصطلحات موضوعية: Receptores acoplados a proteína G (GPCR), Receptor 5-HT2A, Receptor D3, Receptor D2, Ligando, Clozapina, Derivados Benzofuranonas, Risperidona, Olanzapina, esquizofrenia, Derivados Benzofuranonas Derivados Benzolactámico, estudios de relación cuantitativa estructura- acti, Análisis de Componentes Principales (PCA), métodos de regresión, campos de interacción Molecular (MIF), Perfil Multireceptorial, modelado por homología, Docking, sitio de unión, interacciones moleculares, selectividad, afinidad de unión, Diana, Meta-Diana, efectos secundarios, fármaco antipsicótico típico, fármaco antipsicótico atípico, agonista, antagonista, membrana, receptoroma, rhodopsina, estructura de rayos X, descriptores moleculares, farmacología, análisis multivariante, procedimiento integrado, diseño de fármacos asistido por ordenador, Computer-aided drug design, Integrated approach, Multivariate analysis, Pharmacology, Molecular descriptors, X-ray structure, Rhodopsin, Receptorome, Membrane, Antagonist, Agonist, Atypical antipsychotic drug, Typical antipsychotic drug, Side effects, Off-target, Target, Selectivity, Binding affinity, Molecular interactions, Binding site, Homology modeling, Multireceptor profile, Molecular interaction Field (MIF), Partial Least Squares (PLS), Principal Component Analysis (PCA), 3D Quantitave Structural-Activity-Relationship (3D, Schizophrenia, Benzolactam Derivatives, Benzofuranone Derivatives, Risperidone, Olanzapine, Clozapine, Ligand, Adrenergic receptors, Muscarinic receptors, Histamine receptors, Serotonin receptors, Dopamine receptors, beta2-Adrenergic receptor, D2 receptor, D3 receptor, 5-HT2A receptor, G protein-coupled receptors (GPCR)

وصف الملف: application/pdf

URL الوصول: http://www.tdx.cat/TDX-0208111-145107
http://hdl.handle.net/10803/7228

المؤلفون: Vecchio, Alex J, Rathnayake, Sewwandi S, Stroud, Robert M

المصدر: Proceedings of the National Academy of Sciences of the United States of America. 118(15)

مصطلحات موضوعية: Biochemistry and Cell Biology, Biological Sciences, Emerging Infectious Diseases, Infectious Diseases, 2.1 Biological and endogenous factors, Animals, Binding Sites, Claudin-4, Clostridium perfringens, Enterotoxins, Humans, Molecular Docking Simulation, Protein Binding, Sf9 Cells, Spodoptera, Tight Junctions, claudin, tight junction, membrane protein, X-ray structure, enterotoxin

وصف الملف: application/pdf

URL الوصول: https://escholarship.org/uc/item/9j6714hd
https://escholarship.org/content/qt9j6714hd/qt9j6714hd.pdf