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Desmond System Builder

SchrödingerMolecular Dynamics
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The System Builder panel allows you to set up a biological system consisting of proteins, ligands, explicit solvent, membrane, and counter ions, so that you can perform simulations on the system with Desmond.

Backend implementation

$SCHRODINGER/utilities/multisim

Node details

Input ports
  1. Type: Table
    Structure in Maestro format
    Input structure in Maestro format
Output ports
  1. Type: Table
    CMS files
    CMS file

Extension

The Desmond System Builder node is part of this extension:

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Related workflows & nodes

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