ChemoDOTS web server data files

This archive contains files related to the ChemoDOTS web server (https://chemodots.marseille.inserm.fr/) ChemoDOTS_list_of_chemical_functions.xlsx: List of chemical functions recognized by the ChemoDOTS web server and corresponding SMILES. ChemoDOTS_list_of_chemical_reactions.xlsx: List of chemical reactions rimplemented in the ChemoDOTS web server and corresponding SMARTS. ChemoDOTS_MolPort_BBs.smi: Building Blocks from MolPort used in ChemoDOTS (version 2024-03-01) ChemoDOTS_Enamine_BBs.smi: Building Blocks from Enamine used in ChemoDOTS (version 2024-03-01)