Data Collection

Cronin, L. , Rohrbach, S., Siauciulis, M., Chisholm, G. , Saleeb, M., Mehr, H. , Trushina, E., Leotov, A. and Khan, A. (2022) Code and Data for Digitization and validation of a chemical synthesis literature database in the ChemPU. [Data Collection]

Cronin, L. , Caramelli, D., Granda, J. M., Cambie, D., Mehr, H. and Henson, A. (2020) Dataset for A Reactivity First Approach to Autonomous Discovery of New Chemistry. [Data Collection]

Mehr, H. , Craven, M., Leonov, A., Graham, K. and Cronin, L. (2020) Benchmarking results and the XDL XML schema. [Data Collection]