jensengroup / xyz2mol

Converts an xyz file to an RDKit mol object
MIT License
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Valence greater than 4 #26

Closed Ahmadrezauf closed 3 years ago

Ahmadrezauf commented 3 years ago

I was wondering why do you not allow the valence of every atom to be greater than 4.

jhjensen2 commented 3 years ago

The max valence for P and S are 5 and 6, respectively. But 4 is max valence for the carbon row. I don't know of any example where such atoms have a valence larger than 4.