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1
المؤلفون: Niklas Geue, Jackson J. Alcázar, Paola R. Campodónico
المصدر: Molecules; Volume 28; Issue 6; Pages: 2625
مصطلحات موضوعية: Chemistry (miscellaneous), Organic Chemistry, Drug Discovery, non-covalent interactions, density functional theory, methylated cyclodextrins, dimethyl-β-cyclodextrin, hydrogen bond, Molecular Medicine, Pharmaceutical Science, Physical and Theoretical Chemistry, Analytical Chemistry
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2The Network Basis for the Structural Thermostability and the Functional Thermoactivity of Aldolase B
المؤلفون: Guangyu Wang
المصدر: Molecules
Volume 28
Issue 4
Pages: 1850مصطلحات موضوعية: temperature sensitivity, Organic Chemistry, Pharmaceutical Science, cyclization against decyclization, thermoactivity, thermostability, Analytical Chemistry, non-covalent interaction, enzyme, Chemistry (miscellaneous), Drug Discovery, threshold, Molecular Medicine, Physical and Theoretical Chemistry, systemic thermal instability, protein, grid thermodynamics
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3
المؤلفون: Zhimei Tian, Chongfu Song, Hai Wu
المصدر: Molecules
Volume 28
Issue 3
Pages: 1214مصطلحات موضوعية: Hg0, Chemistry (miscellaneous), (ZnS)n clusters, adsorption, Organic Chemistry, Drug Discovery, HgCl and HgCl2, Molecular Medicine, Pharmaceutical Science, electron localization function (ELF), Physical and Theoretical Chemistry, non−covalent interactions (NCI) analysis, Analytical Chemistry
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4
المؤلفون: Kamil Wojtkowiak, Aneta Jezierska
المصدر: Molecules; Volume 27; Issue 24; Pages: 8847
مصطلحات موضوعية: hydrogen bond, non-covalent interactions, spectroscopic signatures, CPMD, PIMD, QTAIM, SAPT, Organic Chemistry, Pharmaceutical Science, Hydrogen Bonding, Benzoic Acid, Analytical Chemistry, Chemistry (miscellaneous), Drug Discovery, Benzamides, Quinolines, Molecular Medicine, Quantum Theory, Physical and Theoretical Chemistry, Protons, Hydrogen
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5
المؤلفون: Santiago Gómez, Sara Gómez, Jorge David, Doris Guerra, Chiara Cappelli, Albeiro Restrepo
المصدر: Molecules; Volume 27; Issue 24; Pages: 8665
مصطلحات موضوعية: cysteine dimers, NBO, NCI, QTAIM, stochastic optimization, hydrogen bonding, salt bridges, non-covalent interactions, Polymers, Chemistry (miscellaneous), Organic Chemistry, Drug Discovery, Quantum Theory, Molecular Medicine, Pharmaceutical Science, Hydrogen Bonding, Cysteine, Physical and Theoretical Chemistry, Analytical Chemistry
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6
المؤلفون: Valentina D. Sasnovskaya, Leokadiya V. Zorina, Sergey V. Simonov, Artem D. Talantsev, Eduard B. Yagubskii
المصدر: Molecules; Volume 27; Issue 23; Pages: 8518
مصطلحات موضوعية: Chemistry (miscellaneous), Organic Chemistry, Drug Discovery, crystal structure, non-covalent interactions, seven-coordinate PBP complexes, dc and ac magnetic properties, spin-glass, metamagnetic transition, field-induced single-molecule magnetism, Molecular Medicine, Pharmaceutical Science, Physical and Theoretical Chemistry, Analytical Chemistry
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7
المؤلفون: Qaim Ali, Yongyong Chen, Ruixue Zhang, Zhewei Li, Yanhui Tang, Min Pu, Ming Lei
المصدر: Molecules; Volume 27; Issue 23; Pages: 8349
مصطلحات موضوعية: DFT, non-covalent interactions, stereoselectivity, asymmetric hydrogenation, oxime, Chemistry (miscellaneous), Organic Chemistry, Drug Discovery, Molecular Medicine, Pharmaceutical Science, Physical and Theoretical Chemistry, Analytical Chemistry
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8Non-Covalent Dimer as Donor Chromophore for Constructing Artificial Light-Harvesting System in Water
المؤلفون: Liangliang Zhang, Hongwei Qian, Zhiying Wu, Qiaona Zhang, Shengke Li, Ming Cheng, Tangxin Xiao
المصدر: Molecules; Volume 27; Issue 24; Pages: 8876
مصطلحات موضوعية: Chemistry (miscellaneous), Organic Chemistry, Drug Discovery, Molecular Medicine, Pharmaceutical Science, Physical and Theoretical Chemistry, aggregation-induced emission, quadruple hydrogen bonding, non-covalent dimer, light-harvesting system, nanoparticles, Analytical Chemistry
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9The Dichotomy of Mn–H Bond Cleavage and Kinetic Hydricity of Tricarbonyl Manganese Hydride Complexes
المؤلفون: Elena S. Osipova, Sergey A. Kovalenko, Ekaterina S. Gulyaeva, Nikolay V. Kireev, Alexander A. Pavlov, Oleg A. Filippov, Anastasia A. Danshina, Dmitry A. Valyaev, Yves Canac, Elena S. Shubina, Natalia V. Belkova
المساهمون: A. N. Nesmeyanov Institute of Organoelement Compounds (INEOS), Russian Academy of Sciences [Moscow] (RAS), Laboratoire de chimie de coordination (LCC), Institut de Chimie de Toulouse (ICT), Institut de Recherche pour le Développement (IRD)-Université Toulouse III - Paul Sabatier (UT3), Université de Toulouse (UT)-Université de Toulouse (UT)-Institut de Chimie du CNRS (INC)-Centre National de la Recherche Scientifique (CNRS)-Institut National Polytechnique (Toulouse) (Toulouse INP), Université de Toulouse (UT)-Institut de Recherche pour le Développement (IRD)-Université Toulouse III - Paul Sabatier (UT3), Université de Toulouse (UT)-Centre National de la Recherche Scientifique (CNRS), Bauman Moscow State Technical University, Moscow Institute of Physics and Technology [Moscow] (MIPT), Russian Science Foundation, CNRS
المصدر: Molecules; Volume 28; Issue 8; Pages: 3368
Molecules
Molecules, 2023, 28 (8), pp.3368. ⟨10.3390/molecules28083368⟩مصطلحات موضوعية: Hydrogen bond, Hydricity, Non-covalent interactions, Organic Chemistry, Pharmaceutical Science, Hydride transfer, Proton transfer, manganese hydrides, hydrogen bond, non-covalent interactions, proton transfer, hydride transfer, hydricity, Analytical Chemistry, [CHIM.THEO]Chemical Sciences/Theoretical and/or physical chemistry, Manganese hydrides, Chemistry (miscellaneous), Drug Discovery, Molecular Medicine, [CHIM.COOR]Chemical Sciences/Coordination chemistry, Physical and Theoretical Chemistry
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10
المؤلفون: Pradeep Risikrishna Varadwaj
المصدر: Molecules; Volume 27; Issue 23; Pages: 8449
مصطلحات موضوعية: Models, Molecular, Anions, Chemistry (miscellaneous), Organic Chemistry, Drug Discovery, Molecular Medicine, Pharmaceutical Science, Thermodynamics, Quantum Theory, tetrel bond, non-covalent interactions, weak-to-strong interaction energy, dative bond formation, chemical bonding, anion recognition, MESP analysis, charge-density analysis, first-principles calculations, Physical and Theoretical Chemistry, Analytical Chemistry
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