JAXChem
latest

Notes

  • Installation
    • pip installation
    • docker installation

Package Reference

  • jaxchem.loss
  • jaxchem.models
    • GCN
    • Readout
  • jaxchem.utils
JAXChem
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  • Index
  • Edit on GitHub

Index

_ | B | E | J | M | P | S | U

_

  • __call__() (PadGCN method)
    • (PadGCNLayer method)
    • (PadGCNPredicator method)
    • (SparseGCN method)
    • (SparseGCNLayer method)
    • (SparseGCNPredicator method)
  • __init__() (EarlyStopping method)
    • (PadGCN method)
    • (PadGCNLayer method)
    • (PadGCNPredicator method)
    • (SparseGCN method)
    • (SparseGCNLayer method)
    • (SparseGCNPredicator method)

B

  • binary_cross_entropy_with_logits() (in module jaxchem.loss)

E

  • EarlyStopping (class in jaxchem.utils)

J

  • jaxchem.loss
    • module
  • jaxchem.models.gcn
    • module
  • jaxchem.models.readout
    • module
  • jaxchem.utils
    • module

M

  • module
    • jaxchem.loss
    • jaxchem.models.gcn
    • jaxchem.models.readout
    • jaxchem.utils

P

  • pad_graph_pooling() (in module jaxchem.models.readout)
  • PadGCN (class in jaxchem.models.gcn)
  • PadGCNLayer (class in jaxchem.models.gcn)
  • PadGCNPredicator (class in jaxchem.models.gcn)

S

  • sparse_graph_pooling() (in module jaxchem.models.readout)
  • SparseGCN (class in jaxchem.models.gcn)
  • SparseGCNLayer (class in jaxchem.models.gcn)
  • SparseGCNPredicator (class in jaxchem.models.gcn)

U

  • update() (EarlyStopping method)

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