Computational Chemistry
SELFIES strings guarantee 100% valid molecules - even when generated randomly

Converting SELFIES Strings to 2D Molecular Images

Learn how to visualize SELFIES molecular representations and explore their unique advantages through random sampling, …

Computational Chemistry
SELFIES representation of 2-Fluoroethenimine molecule

SELFIES (Self-Referencing Embedded Strings)

SELFIES is a 100% robust string-based representation for chemical molecules, designed for machine learning applications …...