NodeConformer Cluster

Source

Conformer Cluster

Backend implementation

$SCHRODINGER/run conformer_cluster.py

Input Ports

  1. Port Type: Data
    Molecules in Maestro format

Output Ports

  1. Port Type: Data
    Clusters in Maestro format

  1. Node Conformer cluster

    Conformer cluster: ClusterCluster conformers based on Cartesian or torsional RMSD. conformers based on Cartesian or tors…
    jcmozzic > Schrodinger workflow examples - 2019-2 > _Nodes > Conformer cluster > Node Conformer cluster

  2. MM Conformational search 1-4

    jcmozzic > Schrodinger workflow examples - 2019-2 > Molecular Mechanics > Conformational search > MM Conformational search 1-4

  3. MM Conformational search 1-3

    jcmozzic > Schrodinger workflow examples - 2019-2 > Molecular Mechanics > Conformational search > MM Conformational search 1-3

  4. MM Conformational search 1-2

    jcmozzic > Schrodinger workflow examples - 2019-2 > Molecular Mechanics > Conformational search > MM Conformational search 1-2