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ConfGen

SchrödingerMolecular MechanicsConformational Search
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Search for ligand conformations like those found in ligand-receptor complexes, with one of several validate search methods, and with optimal minimization of input and output structures.

Backend implementation

$SCHRODINGER/confgenx

Node details

Input ports
  1. Type: Table
    Input in Maestro, Sdf or Mol2 format
    Input in Maestro,Sdf or Mol2 format
Output ports
  1. Type: Table
    Output in Maestro format
    Output in Maestro format

Extension

The ConfGen node is part of this extension:

  1. Go to item

Related workflows & nodes

  1. Go to item
  2. Go to item
  3. Go to item

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