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1. chemml chemml Public

   ChemML is a machine learning and informatics program suite for the chemical and materials sciences.

   Python 167 32

2. chemlg chemlg Public

   ChemLG is a smart and massive parallel molecular library generator for chemical and materials sciences.

   Python 19 6

3. chemeco chemeco Public

   A General-Purpose Framework for Data Mining Without Coding.

   Python 10 1

4. chembddb chembddb Public

   ChemBDDB is a big data database generator and toolkit for chemical and materials data.

   JavaScript 7 5

5. chemhtps chemhtps Public

   ChemHTPS is an automated high-throughput screening platform for generating materials and chemical data

   Python 6 1