OurBigBook Wikipedia Bot Documentation
SMILES (Simplified Molecular Input Line Entry System) is a notation system used to represent chemical structures in a way that can be easily read by both humans and computers. The notation consists of a line of text that encodes the atoms, bonds, connectivity, and sometimes stereochemistry of a molecule. **Arbitrary Target Specification (ATS)** refers to a feature in SMILES that allows for the representation of complex chemical structures, including various modifications and functional groups.

Ancestors (6)

  1. Cheminformatics
  2. Applied statistics
  3. Applied mathematics
  4. Fields of mathematics
  5. Mathematics
  6. Home