Metadata-Version: 1.1
Name: chemfp
Version: 1.3
Summary: A set of command-line tools and a Python toolkit for cheminformatics fingerprint creation and similarity search.
Home-page: http://chemfp.com/
Author: Andrew Dalke
Author-email: dalke@dalkescientific.com
License: MIT
Description: chemfp is a set of command-lines tools for generating cheminformatics
        fingerprints and searching those fingerprints by Tanimoto similarity,
        as well as a Python library which can be used to build new tools.
        
        These algorithms are designed for the dense, 100-10,000 bit
        fingerprints which occur in small-molecule/pharmaceutical
        chemisty. The Tanimoto search algorithms are implemented in C for
        performance and support both threshold and k-nearest searches.
        
        Fingerprint generation can be done either by extracting existing
        fingerprint data from an SD file or by using an existing chemistry
        toolkit. chemfp supports the Python libraries from Open Babel,
        OpenEye, and RDKit toolkits.
        
Platform: UNKNOWN
Classifier: Development Status :: 5 - Production/Stable
Classifier: Environment :: Console
Classifier: License :: OSI Approved :: MIT License
Classifier: Operating System :: Unix
Classifier: Programming Language :: Python :: 2.7
Classifier: Programming Language :: Python :: 2 :: Only
Classifier: Topic :: Scientific/Engineering :: Chemistry
Classifier: Topic :: Software Development :: Libraries :: Python Modules
