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JChem
ChemAxon / Infocom
IO Screen
  1. Node / Manipulator
    Shape Descriptor
    ChemAxon / Infocom JChem Screen
    +1
    Shape descriptor implements a 3D alignment based similarity calculation. At descriptor generation a specific molecule representat…
    0
    infocom
  2. Node / Manipulator
    ECFP/FCFP
    ChemAxon / Infocom JChem Screen
    +1
    ECFPs are circular topological fingerprints designed for molecular characterization, similarity searching, and structure-activity…
    0
    infocom
  3. Node / Manipulator
    Pharmacophore Fingerprint
    ChemAxon / Infocom JChem Screen
    +1
    The fingerprints (which are chemical descriptors) are constructed from sequences of histograms, each of these histograms have the…
    0
    infocom
  4. Node / Source
    MolImporter
    ChemAxon / Infocom JChem IO
    +1
    The input file format is guessed automatically. Many different formats are supported like "mol", "rgf", "sdf", "rdf", "csmol", "c…
    0
    infocom
  5. Node / Source
    Multiple MolImporter
    ChemAxon / Infocom JChem IO
    +1
    The input file format is guessed automatically. Many different formats are supported like "mol", "rgf", "sdf", "rdf", "csmol", "c…
    0
    infocom
  6. Node / Source
    Variable Based MolImporter (deprecated)
    ChemAxon / Infocom JChem IO
    The input file format is guessed automatically. Many different formats are supported like "mol", "rgf", "sdf", "rdf", "csmol", "c…
    0
    infocom