atomistic-machine-learning /SchNet
Atomistic system property prediction
Small molecules · Dynamics · simulation
★ 944 · Updated 2d ago · Licence unknown
- ★
- 18
- Updated
- 1y ago
- Licence
- MIT
- Published
- 2025
- Language
- Python
Summary
Binding free energy prediction and visualization
Input and output
Details
- Access
- Code link found
The paper or list names a code repository. The repository itself was not opened.
- Usage signal
- ★ 18 · Python
Last commit 2025-02-04
- Published
- 2025
The year the source list gave; the exact date was not checked.
- Identifiers
- doi:10.1039/d4sc07405j
Same subject and task
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