NegativData2021 Installation Linux pip install ./Tool_EasyChemML cd Tool_EasyChemML pip install ./rxnfp Windows #install RDkit with conda conda install -c conda-forge rdkit pip install ./Tool_EasyChemML cd Tool_EasyChemML pip install ./rxnfp Using EasyChemML #cd to settings.hjson and run EasyChemML -w ./