Monday, October 11, 2010

SMILES

Simplified Molecular Input Line Entry Specification(SMILES) is a specification of unambiguously describing the stucture of chemical molecules using short ASCII strings.
The table below summarised the topic that we cover in SMILES:









NOTOPIC
1Introduction of SMILES
2SMILES Bonds
3SMILES Branches
4SMILES Atoms
5SMILES Charges
6SMILES Cyclic Structures
7SMILES Conventions and Restrictions
8SMILES Fragments
9SMILES Metals

Tutorials:

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Last but not least, who are interested to know more about SMILES, you can get SMILESCAS Database by clicking here.
Thank you.



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