Beyond RDKit: Benchmarking the Rowan Agent Skill Against Experiment
A reproducible study of pKa, logD, tautomers, ADME, and docking run by an AI agent with the Rowan skill, measured against RDKit and experimental ground truth.
9 min read
Topic
Chemistry
2 K-Dense articles on Chemistry — research automation, benchmarks, and case studies from the K-Dense team.
The Model Is No Longer the Bottleneck
Anthropic showed a general model can rival ChemDraw at NMR. The real story for scientists: the bottleneck has moved from the model to the workflow around it.
6 min read
