Contributors
Dr Jon Kragskow and Dr Gemma Gransbury originally
developed atomaccess under the supervision of Prof. Nicholas Chilton, under an ERC grant (CoG-816268) with PI David P. Mills.
The project is now maintained by these authors at their respective institutions.
We acknowledge Ken Gransbury for help conceptualising the atom_access logo
Citation
To acknowledge atomaccess in your work, please state the atomaccess version number, and cite both of the following publications.
Gemma K. Gransbury, Sophie C. Corner, Jon G. C. Kragskow, Peter Evans, Hing Man Yeung, William J. A. Blackmore, George F. S. Whitehead, Meagan S. Oakley, Iñigo J. Vitorica-Yrezabal, Nicholas F. Chilton, and David P. Mills. Atomaccess: a predictive tool for molecular design and its application to the targeted synthesis of dysprosium single-molecule magnets. Journal of the American Chemical Society, 145:22287–22856, 2023. URL: https://pubs.acs.org/doi/10.1021/jacs.3c08841, doi:10.1021/jacs.3c08841.
The version number can be obtained using the terminal command
pip show atom-access