Molecular-Representation

Dhaked et al.'s comprehensive analysis of tautomerism in chemoinformatics, introducing 86 new tautomeric rules and their …...

Heller et al. (2013) explain how IUPAC's InChI became the global standard for representing chemical structures, its …...

An overview of the major updates to the SELFIES Python library, including improved performance, expanded chemical …...

A summary of the foundational 2020 paper that introduced SELFIES - the 100% robust molecular string representation …

A summary of David Weininger's foundational 1988 paper that introduced SMILES notation - the string-based molecular …

Wang et al.'s novel VLM approach using graph traversal CoT and faithful recognition principles to improve optical …...

Sadawi et al.'s enhanced MolRec system achieving 95%+ accuracy on simple structures but struggling with complex …...

Sadawi et al.'s analysis of MolRec's performance on chemical structure recognition, achieving 95% accuracy on 1000 …...

Morin et al.'s method for creating molecular fingerprints directly from images using instance segmentation of functional …...

A micro-review of Optical Chemical Structure Recognition (OCSR), tracing its evolution from rule-based systems to …

Xiong et al.'s deep learning system for extracting chemical structures from literature images using ResNet-Transformer …...

Fujiyoshi et al.'s segment-based approach for recognizing chemical structures in challenging Japanese patent images with …...