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Работы, на которые ссылается эта работа

Работ: 56

Работа: 3CLpro of SARS-CoV-2 as a new target for bufadienolides: in silico and in vitro study

  1. Polymorphic transitions in single crystals: A new molecular dynamics method

    Michele Parrinello, A. Rahman

    Статья1981Цитирований: 27
    ABI

  2. Canonical sampling through velocity rescaling

    Giovanni Bussi, Davide Donadio, Michele Parrinello

    Статья2007Цитирований: 23
    ABI

  3. SwissADME: a free web tool to evaluate pharmacokinetics, drug-likeness and medicinal chemistry friendliness of small molecules

    Antoine Daina, Olivier Michielin, Vincent Zoete

    Статья2017Цитирований: 22
    ABI

  4. CB-Dock2: improved protein–ligand blind docking by integrating cavity detection, docking and homologous template fitting

    Yang Liu, Xiaocong Yang, Jianhong Gan +3

    Статья2022Цитирований: 17
    ABI

  5. A Novel Coronavirus from Patients with Pneumonia in China, 2019

    Na Zhu, Dingyu Zhang, Wenling Wang +15

    Статья2020Цитирований: 11
    ABI

  6. THE weighted histogram analysis method for free‐energy calculations on biomolecules. I. The method

    Shankar Kumar, John M. Rosenberg, Djamal Bouzida +2

    Статья1992Цитирований: 10
    ABI

  7. Structure and Dynamics of the TIP3P, SPC, and SPC/E Water Models at 298 K

    Pekka Mark, Lennart Nilsson

    Статья2001Цитирований: 8
    ABI

  8. Chemical composition and biological activity of total bufadienolides from the Central-Asian Bufo viridis toad venom

    Azamjon B. Soliev, Sh. Ya. Mirzaakhmedov, М. С. Ташмухамедов +7

    СтатьяIon Transport and Channel RegulationPharmaceutical Chemistry Journal2007Цитирований: 6
    ABI

  9. Experimental and computational approaches to estimate solubility and permeability in drug discovery and development settings 1PII of original article: S0169-409X(96)00423-1. The article was originally published in Advanced Drug Delivery Reviews 23 (1997) 3–25. 1

    Christopher A. Lipinski, Franco Lombardo, Beryl W. Dominy +1

    Обзорная статья2001Цитирований: 5
    ABI

  10. Boceprevir, GC-376, and calpain inhibitors II, XII inhibit SARS-CoV-2 viral replication by targeting the viral main protease

    Chunlong Ma, M. Sacco, Brett L. Hurst +8

    Статья2020Цитирований: 4
    ABI

  11. Bias-force guided simulations combined with experimental validations towards GPR17 modulators identification

    Sana Kari, Akshaya Murugesan, Ramesh Thiyagarajan +5

    СтатьяReceptor Mechanisms and SignalingBiomedicine & Pharmacotherapy2023Цитирований: 3
    ABI

  12. Toad venom bufadienolides and bufotoxins: An updated review

    Akmal M. Asrorov, Muzaffar Kayumov, Nurkhodja Mukhamedov +8

    Обзорная статьяIon Transport and Channel RegulationDrug Development Research2023Цитирований: 3
    ABI

  13. Chemical profiling and cytotoxicity assay of bufadienolides in toad venom and toad skin

    Qiong Meng, Lee‐Fong Yau, Jing‐Guang Lu +4

    Статья2016Цитирований: 3
    ABI

  14. Bufadienolides originated from toad source and their anti-inflammatory activity

    Denglang Zou, Qiqi Wang, Tao Chen +8

    Обзорная статья2022Цитирований: 2
    ABI

  15. SwissParam: A fast force field generation tool for small organic molecules

    Vincent Zoete, Michel A. Cuendet, Aurélien Grosdidier +1

    Статья2011Цитирований: 2
    ABI

  16. ESOL:  Estimating Aqueous Solubility Directly from Molecular Structure

    John Delaney

    Статья2004Цитирований: 2
    ABI

  17. Does CO2 Permeate through Aquaporin-1?

    Jochen S. Hub, Bert L. de Groot

    Статья2006Цитирований: 2
    ABI

  18. Revisiting the General Solubility Equation: <i>In Silico</i> Prediction of Aqueous Solubility Incorporating the Effect of Topographical Polar Surface Area

    Jogoth Ali, Patrick Camilleri, Marc B. Brown +2

    Статья2011Цитирований: 2
    ABI

  19. COVID-19: angiotensin-converting enzyme 2 (ACE2) expression and tissue susceptibility to SARS-CoV-2 infection

    Stephany Beyerstedt, Expedito Barbosa Casaro, Érika Bevilaqua Rangel

    Обзорная статья2021Цитирований: 2
    ABI

  20. Computational and in vitro evaluation of sumac-derived ©Rutan compounds towards Sars-CoV-2 Mpro inhibition

    Muzaffar Kayumov, Parthiban Marimuthu, Jamoliddin Razzokov +8

    СтатьяMedicinal Plant ResearchFrontiers in Pharmacology2025Цитирований: 1
    ABI

  21. Без названия

    ДругоеЦитирований: 1
    ABI

  22. Без названия

    ДругоеЦитирований: 1
    ABI

  23. Без названия

    ДругоеЦитирований: 1
    ABI

  24. Без названия

    ДругоеЦитирований: 1
    ABI

  25. Без названия

    ДругоеЦитирований: 1
    ABI