hippynn

Getting Started:

What is hippynn?
How to install hippynn
Research articles using hippynn
License

User Guide:

hippynn Features
hippynn Concepts
Databases
Model and Loss Graphs
Units in hippynn
Custom Kernels
Library Settings
Creating Custom Node Types

Examples:

Minimal Workflow
Controller
Plotting
Predictor
Ensembling Models
Periodic Boundary Conditions
Force Training
Restarting training
ASE Calculators
LAMMPS interface
Non-Adiabiatic Excited States
Weighted/Masked Loss Functions
Pytorch Lightning module
Hyperparameter optimization with Ax and Ray

API Documentation:

Full API Documentation
API Summary Pages

hippynn

hippynn
molecular_dynamics
readers module
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readers module

Full Documentation for hippynn.molecular_dynamics.readers module. Click here for a summary page.

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