u/a_r1211

Wondering how many of you actually use machine learning in your research? Anything ranging from MLIPs for MD simulations to drug discovery tools as starting points for drug design.

Going through the sub‘s history, I saw that the main challenges were the extensive data requirements and false confidence of current ML tools. Are there any other key limitations that you guys consider prevalent in the field?

Just trying to scope out some opinions for a project. DMs are welcome and I would love to chat with any researchers for 5-10 minutes if possible (not trying to sell anything don’t worry). Thanks!