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Ensemble docking

LiveDesign Glide LigPrep Schrodinger
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Docks the compounds with Glide in 2 binding site conformations and reports the binding site conformation where it scores the best and the corresponding docking pose. [32681] 22.2.4

Used extensions & nodes

Created with KNIME Analytics Platform version 4.6.1 Note: Not all extensions may be displayed.
  • KNIME Base Chemistry Types & Nodes Trusted extension

    KNIME AG, Zurich, Switzerland

    Version 4.5.0

    knime
  • KNIME Base nodes Trusted extension

    KNIME AG, Zurich, Switzerland

    Version 4.5.1

    knime
  • KNIME Basic File System Connectors Trusted extension

    KNIME AG, Zurich, Switzerland

    Version 4.6.1

    knime
  • KNIME Javasnippet Trusted extension

    KNIME AG, Zurich, Switzerland

    Version 4.6.0

    knime
  • KNIME Quick Forms Trusted extension

    KNIME AG, Zurich, Switzerland

    Versions 4.3.2, 4.6.0

    knime
  • Schrödinger Extensions for KNIME Trusted extension

    Schrödinger

    Versions 21.3.79, 22.2.110, 22.4.125

    Schroedinger profile image
    schroedinger
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