Package schrodinger :: Package analysis

Package analysis


A package for analysis modules.

enrichment:
    A module for calculating Enrichment Factors and reporting on the
    effectiveness of a ligand database screen seeded with known actives.

Submodules

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schrodinger.analysis.cluster: Provides a class for clustering a set of values - for example, 3D coordinates.
schrodinger.analysis.enrichment: A module for calculating Enrichment Factors and reporting on the effectiveness of a ligand database screen seeded with known actives.
schrodinger.analysis.reaction: A module to support chemical reactions, retrosynthetic analysis, and reaction enumeration.
schrodinger.analysis.transformations: Module to support chemical transformations defined via reaction SMARTS (RDKit dialect).
schrodinger.analysis.visanalysis: Molecular structures reside in a three-dimensional world and naturally enough give rise to three-dimensional data.

Variables

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__package__ = None
hash(x)