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Molecular Diversity|June 30, 2022
Identification of potential matrix metalloproteinase-2 inhibitors from natural products through advanced machine learning-based cheminformatics approachesRuoqi Yang, Guiping Zhao, Bin Cheng, et al.Molecular Diversity|July 12, 2022
Natural flavonoids effectively block the CD81 receptor of hepatocytes and inhibit HCV infection: a computational drug development approachDipta Dey, Partha Biswas, Priyanka Paul, et al.Molecular Diversity|May 29, 2019
Pharmacophore features for machine learning in pharmaceutical virtual screeningXiaojing Wang, Wenxiu Han, Xin Yan, et al.Molecular Diversity|October 9, 2021
Development of a proteochemometric-based support vector machine model for predicting bioactive molecules of tubulin receptorsOdame Agyapong, Whelton A Miller, Michael D Wilson, et al.Molecular Diversity|October 9, 2021
Novel B, C-ring truncated deguelin derivatives reveals as potential inhibitors of cyclin D1 and cyclin E using molecular docking and molecular dynamic simulationKiran Bharat Lokhande, Payel Ghosh, Shuchi Nagar, et al.Molecular Diversity|October 12, 2021
Building 2D classification models and 3D CoMSIA models on small-molecule inhibitors of both wild-type and T790M/L858R double-mutant EGFRDonghui Huo, Hongzhao Wang, Zijian Qin, et al.Molecular Diversity|May 3, 2022
Molecular dynamics, MMGBSA, and docking studies of natural products conjugated to tumor-targeted peptide for targeting BRAF V600E and MERTK receptorsDominic J Lambo, Charlotta G Lebedenko, Paige A McCallum, et al.Molecular Diversity|May 22, 2010
Impact of Mercury(II) on proteinase K catalytic center: investigations via classical and Born-Oppenheimer molecular dynamicsJarosław J Panek, Riccardo Mazzarello, Marjana Novič, et al.Molecular Diversity|September 4, 2010
Novel coumarin-based tyrosinase inhibitors discovered by OECD principles-validated QSAR approach from an enlarged, balanced databaseHuong Le-Thi-Thu, Gerardo M Casañola-Martín, Yovani Marrero-Ponce, et al.Molecular Diversity|July 24, 2010
New multicomponent approach for the synthesis of benzo[c]coumarin derivatives over MgO under solvent-free conditionsHassan Valizadeh, Ashraf FakhariPageof 287