يعرض 1 - 10 نتائج من 1,464 نتيجة بحث عن '"In silico Screening"', وقت الاستعلام: 1.17s تنقيح النتائج
  1. 1
    دورية أكاديمية
    A first-in-class dimethyl 2-acetamido terephthalate inhibitor targeting Conyza canadensis SHMT1 with a novel herbicidal mode-of-action

    المؤلفون: Dingfeng Luo, Zhendong Bai, Haodong Bai, Na Liu, Jincai Han, Changsheng Ma, Di Wu, Lianyang Bai, Zuren Li

    المصدر: Journal of Advanced Research, Vol 62, Iss , Pp 59-70 (2024)

    مصطلحات موضوعية: Herbicide target, Serine hydroxymethyltransferase (SHMT), Crystal structure, In silico screening, Synthesis, Medicine (General), R5-920, Science (General), Q1-390

    وصف الملف: electronic resource

    Relation: http://www.sciencedirect.com/science/article/pii/S2090123223002953; https://doaj.org/toc/2090-1232

    URL الوصول: https://doaj.org/article/c0906be692cc4a4996faaa2365af8c06

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  2. 2
    مؤتمر
    Machine Learning Methods In Drug Discovery: A Selective Review

    المؤلفون: Abdelkrim, Ali, Bouramoul, Abdelkrim, Zenbout, Imene

    المصدر: 2021 International Conference on Theoretical and Applicative Aspects of Computer Science (ICTAACS) Theoretical and Applicative Aspects of Computer Science (ICTAACS), 2021 International Conference on. :1-8 Dec, 2021

    Relation: 2021 International Conference on Theoretical and Applicative Aspects of Computer Science (ICTAACS)

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  3. 3
    دورية أكاديمية
    Analysis of the Structural Transformations Underlying the Design of Innovative Next-in-Class Drugs

    المؤلفون: Balakin, K. V.Aff1, Aff2, IDS107036322315001X_cor1

    المصدر: Russian Journal of General Chemistry. 93(Suppl 2):S401-S425

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  4. 4
    دورية أكاديمية
    Repurposing of known drugs from multiple libraries to identify novel and potential selective inhibitors of HDAC6 via in silico approach and molecular modeling

    المؤلفون: Naz Mina Mert, Buse Erdogan, Kemal Yelekçi

    المصدر: Heliyon, Vol 10, Iss 15, Pp e35020- (2024)

    مصطلحات موضوعية: HDAC6, Cancer, In silico screening, Docking, M.D. simulation, HDAC6 selective inhibitors, Science (General), Q1-390, Social sciences (General), H1-99

    وصف الملف: electronic resource

    Relation: http://www.sciencedirect.com/science/article/pii/S2405844024110511; https://doaj.org/toc/2405-8440

    URL الوصول: https://doaj.org/article/8e8346387d1f4bd9b37223dccb428c0b

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  5. 5
    دورية أكاديمية
    In silico enzyme screening identifies an SDR ketoreductase from Thermus caliditerrae as an attractive biocatalyst and promising candidate for protein engineering

    المؤلفون: Yvett Sosa, Bhav Kapur, Jessica Hurtak, Laura J. Kingsley, Hao Wu, Stefanie Gruber, Herbert Nar, Saad Khattabi, Jesus Seco Moral, Maria Fátima Lucas, Caterina Martin, Nikola Lončar, Frederic Buono, Noah Pefaur, Andrew E. Nixon, Jinhua J. Song

    المصدر: Frontiers in Chemical Biology, Vol 3 (2024)

    مصطلحات موضوعية: ketoreductase, kinetic resolution, in silico screening, asymmetric synthesis, BioMatchMaker, biocatalysis, Biology (General), QH301-705.5, Chemistry, QD1-999

    وصف الملف: electronic resource

    Relation: https://www.frontiersin.org/articles/10.3389/fchbi.2024.1425501/full; https://doaj.org/toc/2813-530X

    URL الوصول: https://doaj.org/article/9cf8af4a995a453ca62582f81e558283

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  6. 6
    دورية أكاديمية
    Data on molecular docking and molecular dynamics targeting Mycobacterium tuberculosis shikimic acid kinase

    المؤلفون: Hinata Taniguchi, Shuhei Kawamoto, Kohei Monobe, Shunsuke Aoki

    المصدر: Data in Brief, Vol 54, Iss , Pp 110370- (2024)

    مصطلحات موضوعية: Docking simulation, In silico screening, Molecular dynamics, Tuberculosis, Computer applications to medicine. Medical informatics, R858-859.7, Science (General), Q1-390

    وصف الملف: electronic resource

    Relation: http://www.sciencedirect.com/science/article/pii/S2352340924003391; https://doaj.org/toc/2352-3409

    URL الوصول: https://doaj.org/article/1282413d69e04c8ea76983825a4b7861

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  7. 7
    دورية أكاديمية
    Repurposed drugs in combinations exert additive anti-chikungunya virus activity: an in-vitro study

    المؤلفون: Kusuma Sai Davuluri, Rajnandini Ghanghav, Gunwant Ahire, Mahadeo Kakade, Sarah Cherian, Kalichamy Alagarasu, Deepti Parashar

    المصدر: Virology Journal, Vol 21, Iss 1, Pp 1-10 (2024)

    مصطلحات موضوعية: Chikungunya virus (CHIKV), Drug repurposing, Combination of repurposed drugs, Synergistic effect, In silico screening, In vitro validation, Infectious and parasitic diseases, RC109-216

    وصف الملف: electronic resource

    Relation: https://doaj.org/toc/1743-422X

    URL الوصول: https://doaj.org/article/7b3ce3dbdac240f2a2a9fcbd15c05534

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  8. 8
    دورية أكاديمية
    Novel in silico screening system for plant defense activators using deep learning-based prediction of reactive oxygen species accumulation

    المؤلفون: Masayuki Kogoshi, Daiki Nishio, Nobutaka Kitahata, Hayato Ohwada, Kazuyuki Kuchitsu, Hideyuki Mizuno, Takamitsu Kurusu

    المصدر: Plant Methods, Vol 19, Iss 1, Pp 1-14 (2023)

    مصطلحات موضوعية: Reactive oxygen species (ROS), Chemical property, Deep neural network (DNN), In silico screening, Pesticides, Plant defense activators, Plant culture, SB1-1110, Biology (General), QH301-705.5

    وصف الملف: electronic resource

    Relation: https://doaj.org/toc/1746-4811

    URL الوصول: https://doaj.org/article/4c2b27a4215c412ebd084e8793889df9

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  9. 9
    دورية أكاديمية
    Novel in silico screening system for plant defense activators using deep learning-based prediction of reactive oxygen species accumulation

    المؤلفون: Kogoshi, MasayukiAff1, IDs13007023011187_cor1, Nishio, Daiki, Kitahata, Nobutaka, Ohwada, Hayato, Kuchitsu, Kazuyuki, Mizuno, Hideyuki, Kurusu, TakamitsuAff1, IDs13007023011187_cor7

    المصدر: Plant Methods. 19(1)

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  10. 10
    دورية أكاديمية
    Ligand-based virtual-screening identified a novel CFTR ligand which improves the defective cell surface expression of misfolded ABC transporters

    المؤلفون: Shogo Taniguchi, Francois Berenger, Yukako Doi, Ayana Mimura, Yoshihiro Yamanishi, Tsukasa Okiyoneda

    المصدر: Frontiers in Pharmacology, Vol 15 (2024)

    مصطلحات موضوعية: CFTR, ligand, ABCB1, in silico screening, cystic fibrosis, Therapeutics. Pharmacology, RM1-950

    وصف الملف: electronic resource

    Relation: https://www.frontiersin.org/articles/10.3389/fphar.2024.1370676/full; https://doaj.org/toc/1663-9812

    URL الوصول: https://doaj.org/article/2346a245720c4578b737a17b1470e10a

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