how to write mol to mol2file?? #3647
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I want to write mol of rdkit as mol2 file. I want to save in mol2 format in 3d, what should I do? |
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Answered by
greglandrum
Dec 17, 2020
Replies: 1 comment 1 reply
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The RDKit is not able to write Mol2 files due to the ambiguity of the format definition. |
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1 reply
Answer selected by
greglandrum
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The RDKit is not able to write Mol2 files due to the ambiguity of the format definition.
Doing a bit of web searching will turn up numerous discussion about why this is the case.