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gc-fid-simulator Public
A Gas Chromatography Simulator built on the LSER Model
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RDKIT-Draw-Chems-From-SMILES Public
Simple script for using RDKIT library to parse SMILES strings and output small images
Python UpdatedJun 28, 2023 -
CAS-To-Molecular-Formula Public
Web Scraping script that scrapes NIST Chemistry Web Book and parses chemical formula based on CAS number queried. Outputs chemical formula with each atom as a field and an atom-count as a value.
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