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Virtual Screening

Docking Glide QikProp LigPrep
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Structure-based Virtual Screening Workflow incorporating ligand preparation, property filtering, and successive docking using different Glide modes (HTVS, SP, XP). [Requires: Glide, QikProp, LigPrep]

Used extensions & nodes

Created with KNIME Analytics Platform version 4.1.0
  • KNIME Base Chemistry Types & Nodes Trusted extension

    KNIME AG, Zurich, Switzerland

    Version 3.7.0

    knime
  • KNIME Core Trusted extension

    KNIME AG, Zurich, Switzerland

    Version 3.7.1

    knime
  • Schrödinger Extensions for KNIME Trusted extension

    Schrödinger

    Version 19.4.7

    Schrodinger - https://www.schrodinger.com profile image
    schroedinger
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