Overview: Hacker News discussed LLMs in chemistry, comparing them to human chemists. Key points: LLMs lack intuition & practical experience, but excel at processing vast data. Explored their future impact on chemistry & knowledge work. #ChemistryAI 1/5
3/7 AI breakthrough: Fed chemistry database to AI model, which recommended lithium trifluoromethanesulfinate (LiSO2CF3) salt. 'We had no idea what molecules could do that job, so we used machine learning to help us,' says researcher Chihao Zhao.
#MachineLearning #ChemistryAI
🚀ChemBench just leveled up!
We’re thrilled to announce the latest release of ChemBench—now smarter and smoother! Dive into benchmarking any chemistry AI model with our revamped framework, designed for flexibility and ease.
#ChemistryAI #MachineLearning #OpenScience #Innovation
Check out my paper on arxiv with Christoph Ortner and
Julia Westermayr introducing a Transferable Machine Learning Potential for Excited States using DeepSets:
lnkd.in/eq5uBcXm
#ChemistryAI #ML #CompChem
