Search Results - "Quantum Chemistry"

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  1. 21
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    Flavones' and Flavonols' Antiradical Structure-Activity Relationship-A Quantum Chemical Study by Maciej Spiegel, Tadeusz Andruniów, Zbigniew Sroka

    Published 2020
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  2. 22
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    Antioxidant Potential of Psychotropic Drugs: From Clinical Evidence to In Vitro and In Vivo Assessment and toward a New Challenge for in Silico Molecular Design by Giovanni Ribaudo, Marco Bortoli, Chiara Pavan, Giuseppe Zagotto, Laura Orian

    Published 2020
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  3. 23
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    The Synergy between Glutathione and Phenols-Phenolic Antioxidants Repair Glutathione: Closing the Virtuous Circle-A Theoretical Insight by Mirzam Carreon-Gonzalez, Juan Raúl Alvarez-Idaboy

    Published 2023
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  4. 24
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    Chapter 2 Essential Thermochemical and Biological Powers by Koons, Robert C.

    Published 2022
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  5. 25
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    Amphiphilic small molecular mates match hydrophobic drugs to form nanoassemblies based on drug-mate strategy by Leiqiang Han, Shuang Liang, Weiwei Mu, Zipeng Zhang, Limin Wang, Shumin Ouyang, Bufan Yao, Yongjun Liu, Na Zhang

    Published 2022
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  6. 26
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    Chapter 2 Essential Thermochemical and Biological Powers by Koons, Robert C.

    Published 2022
    OAPEN Library: download the publication
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  7. 27
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    SIMULATION OF VINPOCETINE RELEASE PROCESS FROM MICROCAPSULES WITH HYDROPHOBIC SHELL by Yu. A. Polkovnikova, A. A. Glushko, I. Yu. Mikhailovskaya, Yo. S. Karieva

    Published 2017
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  8. 28
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    Assessment of electroencephalography modification by antipsychotic drugs in patients with schizophrenia spectrum disorders using frontier orbital theory: A preliminary study by Takashi Ozaki, Koichiro Mikami, Atsuhito Toyomaki, Naoki Hashimoto, Yoichi M. Ito, Ichiro Kusumi

    Published 2023
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  9. 29
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    Discovering Photoswitchable Molecules for Drug Delivery with Large Language Models and Chemist Instruction Training by Junjie Hu, Peng Wu, Yulin Li, Qi Li, Shiyi Wang, Yang Liu, Kun Qian, Guang Yang

    Published 2024
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  10. 30
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    Conformation, energies and complexation between alkali cations and aspartic acid by Wichien Sang-aroon

    Published 2014
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  11. 31
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    Antidiabetic Bis-Maltolato-OxoVanadium(IV): Conversion of inactive trans- to bioactive cis-BMOV for possible binding to target PTP-1B by Thomas Scior, Hans-Georg Mack, José Antonio Guevara García, Wolfhard Koch

    Published 2008
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  12. 32
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    DFT-analysis of protolytic equivalents of 5-(aryl)-4-(methyl,amino)-1,2,4-triazole-3(2H)-thione by O. A. Bihdan, N. A. Alk Khalaf

    Published 2022
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  13. 33
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    Theoretical investigation of photoinduced electron transfer in flavodoxin from molecular dynamics simulation data by Kiattisak Lugsanangarm

    Published 2013
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