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Extra precision docking, free energy calculation and molecular dynamics simulation studies of CDK2 inhibitors - MaRDI portal

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Extra precision docking, free energy calculation and molecular dynamics simulation studies of CDK2 inhibitors (Q1790820)

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scientific article; zbMATH DE number 6946685
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English
Extra precision docking, free energy calculation and molecular dynamics simulation studies of CDK2 inhibitors
scientific article; zbMATH DE number 6946685

    Statements

    Extra precision docking, free energy calculation and molecular dynamics simulation studies of CDK2 inhibitors (English)
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    4 October 2018
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    cell-cycle
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    glide XP docking
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    MM-GBSA
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    binding free energy
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    biological activity
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