SWAN
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Contents:
Screening Workflows And Nanomaterials
Tutorial to Generate Statistical Models
Available models
Training and validation
API Data Representation
API Statistical Models
SWAN
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Welcome to SWAN!
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Welcome to SWAN!
¶
Contents:
Screening Workflows And Nanomaterials
🛠 Installation
Tutorial to Generate Statistical Models
Simulation input
Training a model
Predicting new data
Available models
Fully Connected Neural Network
Message Passing Neural Network
Training and validation
API Data Representation
Data Base Class
Graph Data Base Class
Fingerprints Data
Torch Geometric Data
DGL Data
API Statistical Models
Deep Feedforward Network
Message Passing Graph Neural Network
Equivariant Neural Networks
Indices and tables
¶
Index
Module Index
Search Page
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