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Extracting SMILES codes from open chemical databases

Today we luckily have a lot of open scientific databases readily available on the web which are packed with a lot of valuable chemical information. In my case, I recently had the task to collect thousands of SMILES codes of various chemical substances in a swift and pragmatic manner. For Read more…

By Angelika Keller, 4 yearsAugust 25, 2021 ago
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