NInChI: Toward a Chemical Identifier for Nanomaterials
Lynch et al. propose NInChI (Nanomaterials InChI) - a standardized notation system for representing complex …
Chemical-Notation
SELFIES: The Original Paper (Krenn et al. 2020)
A summary of the foundational 2020 paper that introduced SELFIES - the 100% robust molecular string representation …
SMILES: The Original Paper (Weininger 1988)
A summary of David Weininger's foundational 1988 paper that introduced SMILES notation - the string-based molecular …