cell2mol: encoding chemistry to interpret crystallographic data
Computational Chemistry Daily,
nature.com - The creation and maintenance of crystallographic data repositories is one of the greatest data-related…
nature.com - The creation and maintenance of crystallographic data repositories is one of the greatest data-related…
Over the last several decades, cheminformatics has managed to produce a few dozen different ways to exchange molecular…
An article describing the development and usage of the COD SMILES collection has just been in Journal of Cheminformatics.