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
See more details on https://kni.me/w/0iiFZOzYPqbTutC-
Workflow
Ensemble docking
Used extensions & nodes
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KNIME AG, Zurich, Switzerland
Version 4.5.0
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KNIME AG, Zurich, Switzerland
Version 4.5.1
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KNIME AG, Zurich, Switzerland
Version 4.6.1
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KNIME AG, Zurich, Switzerland
Version 4.6.0
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KNIME AG, Zurich, Switzerland
Versions 4.3.2, 4.6.0
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Schrödinger
Versions 21.3.79, 22.2.110, 22.4.125
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