Artificial Intelligence for Chemical Synthesis: Improving the Workflow of Medicinal Chemists using Computer-Aided Synthesis Planning
Machine learning techniques have numerous applications in modern drug discovery. Advances in computing power, machine learning algorithms and data availability have inspired renewed interest in artificial intelligence and automation in chemical synthesis. The field of Computer-Aided Synthesis Planni...
| Main Author: | Haywood, Alexe L. |
|---|---|
| Format: | Thesis (University of Nottingham only) |
| Language: | English |
| Published: |
2024
|
| Subjects: | |
| Online Access: | https://eprints.nottingham.ac.uk/77169/ |
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