#ChemPython

Catch mass (m) & substance amount (n) errors in PDFs! This tool comes handy, but expect false positives for now.
Link: huggingface.co/spaces/Match...

Explore more #OpenChemTools:

Accurate Mass: huggingface.co/spaces/Match...
SI Check: huggingface.co/spaces/Match... #ChemPython #ChemSky

Impressed by Gemini 2.5 Pro to create lecture material: "Can you write a python script that generates a ball and stick model of a rotating water molecule that also show the two planes of symmetry and the c2 axis in a semitransparent Fashion“ #AI #GeminiAI #ChemPython #ChemSky #SciVis @GoogleAI

Thanks to everyone on #ChemSky who shared suggestions via DM or in the comments on expanding 🧪 SI checking. It’s evolving, thanks to #vibecoding #ChemPython

Lab report grading got you down? 😩 We're building an automated feedback tool! Share your common lab report errors that drive you nuts as regular expression (regex) in combination with a comment line.
Example: r'\b\d+(?:.\d+)?\s+ml\b' catches "ml" vs "mL".
#ChemEd #LabLife #LLM #ChemSky #ChemPython

What I Learned from Analyzing Accurate Mass Data of 3000 Supporting Information Files A Python script for the systematic, high-throughput analysis of accurate mass data was developed and tested on more than 3000 Supporting Information (SI) PDFs from Organic Letters. For each SI file, q...

📊 What I learned from analyzing 3000+ SI PDFs: Only 40% of papers w/ #MassSpectrometry data compliant w/ journal guidelines! From zero #Python experience to an automated checker

Read the paper:
pubs.acs.org/doi/10.1021/...
Try the tool: github.com/match22lab/H...

#DataScience #ChemPython #ChemSky

What I Learned from Analyzing Accurate Mass Data of 3000 SI Files A Python script for the systematic, high-throughput analysis of accurate mass data was developed and tested on over 3,000 Supporting Information (SI) PDFs from Organic Letters. For each SI file, quadr...

The corresponding #ChemRxiv can be found here: chemrxiv.org/engage/chemr...

#ChemPython #ChemSky #ChemTwitter

HRMS-Checker 2.0 #ChemPython #ChemSky now available on GitHub: github.com/match22lab/H...