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Have you made plans for reconciling forms of sugars? For example, glucose can exist in an open and closed form. I recently integrated a large number of chemical databases (before knowing about MolVS) and am going through the well-documented woes you describe in this package.
I'm excited to switch my fragmented code for cleaning structures over to your MolVS protocols. The canonical tautomer is something really significant for me. Thanks for putting this together.
The text was updated successfully, but these errors were encountered:
Have you made plans for reconciling forms of sugars? For example, glucose can exist in an open and closed form. I recently integrated a large number of chemical databases (before knowing about MolVS) and am going through the well-documented woes you describe in this package.
Here is an example for glucose: https://en.wikipedia.org/wiki/Glucose#Open-chain_form
I'm excited to switch my fragmented code for cleaning structures over to your MolVS protocols. The canonical tautomer is something really significant for me. Thanks for putting this together.
The text was updated successfully, but these errors were encountered: