SLNSW-Lead generation of cysteine based mesenchymal epi...-TN_cdi_proquest_miscellaneous_2658232316

Lead generation of cysteine based mesenchymal epithelial transition (c-Met) kinase inhibitors: Using structure-based scaffold hopping, 3D-QSAR pharmacophore modeling, virtual screening, molecular docking, and molecular dynamics simulation

Full title: Lead generation of cysteine based mesenchymal epithelial transition (c-Met) kinase inhibitors: Using structure-based scaffold hopping, 3D-QSAR pharmacophore modeling, virtual screening, molecular docking, and molecular dynamics simulation

Author/creator: Raafat, Asmaa, Mowafy, Samar, Abouseri, Sahar M., Fouad, Marwa A., Farag, Nahla A..

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Record Identifier: TN_cdi_proquest_miscellaneous_2658232316

Language: English

Formats: Articles

Publishers: United States: Elsevier Ltd

Permalink: https://collection.sl.nsw.gov.au/record/TN_cdi_proquest_miscellaneous_2658232316

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    Lead generation of cysteine based mesenchymal epithelial transition (c-Met) kinase inhibitors: Using structure-based scaffold hopping, 3D-QSAR pharmacophore modeling, virtual screening, molecular docking, and molecular dynamics simulation

    Record identifier

    TN_cdi_proquest_miscellaneous_2658232316

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    https://collection.sl.nsw.gov.au/record/TN_cdi_proquest_miscellaneous_2658232316

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    Lead generation of cysteine based mesenchymal epithelial transition (c-Met) kinase inhibitors: Using structure-based scaffold hopping, 3D-QSAR pharmacophore modeling, virtual screening, molecular docking, and molecular dynamics simulation

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    https://collection.sl.nsw.gov.au/record/TN_cdi_proquest_miscellaneous_2658232316

    Lead generation of cysteine based mesenchymal epithelial transition (c-Met) kinase inhibitors: Using structure-based scaffold hopping, 3D-QSAR pharmacophore modeling, virtual screening, molecular docking, and molecular dynamics simulation

    Full title

    Lead generation of cysteine based mesenchymal epithelial transition (c-Met) kinase inhibitors: Using structure-based scaffold hopping, 3D-QSAR pharmacophore modeling, virtual screening, molecular docking, and molecular dynamics simulation

    Author / Creator

    Raafat, Asmaa ; Mowafy, Samar ; Abouseri, Sahar M. ; Fouad, Marwa A. ; Farag, Nahla A.

    Publisher

    United States: Elsevier Ltd

    Journal title

    Computers in biology and medicine, 2022, Vol.146, p.105526-105526

    Record Identifier

    TN_cdi_proquest_miscellaneous_2658232316

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    English

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    Algorithms Amino acids Analysis Angiogenesis Anti-angiogenesis Binding sites Bioavailability Biological activity c-Met protein c-Met tyrosine kinase Cabozantinib Clinical trials Confidence intervals Correlation coefficient Correlation coefficients Crystal structure Cysteine Discovery studio software Drug development Energy Growth factors Hydrogen Hydrogen bonds Hydrophobicity HypoGen algorithm Inhibitors Kinases Lead optimization Ligands Lung cancer Mapping Mesenchyme Molecular docking Molecular dynamics Molecular structure Mutation Optimization Performance prediction Pharmacology Pharmacophore modeling Physiology Protein-tyrosine kinase receptors Proteins Scaffold hopping Scaffolds Screening Simulation Software Statistical analysis Stem cells Structure-activity relationships Targeted cancer therapy Three dimensional models Tumors Tyrosine

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    TN_cdi_proquest_miscellaneous_2658232316

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    https://collection.sl.nsw.gov.au/record/TN_cdi_proquest_miscellaneous_2658232316

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