Chemxus

Cheminformatics

Molecules as information.

Learn how chemical structures become data that can be stored, searched, and compared.

C01

What is cheminformatics?

Cheminformatics gives molecules digital representations so we can store, search, compare, and analyze chemical information.

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C02

A first look at SMILES

SMILES writes a molecular graph as text. Small examples reveal both its usefulness and its limits.

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