Institution
London Mathematical Laboratory
GBfacility
Recent research
- AI & ComputingOpen access
Embedded Morgan Fingerprints for More Efficient Molecular Property Predictions With Machine Learning
High‐dimensional molecular fingerprints have become a quiet bottleneck for chemical machine learning, where bit collisions in large, chemically diverse datasets and escalating computational costs constrain model discovery. This work introduces the embedded Morgan Fingerprint (eMF...