torchdrug.datasets
==================

.. currentmodule:: torchdrug.datasets

Knowledge Graph Datasets
------------------------

FB15k
^^^^^
.. autoclass:: FB15k
    :members:

FB15k237
^^^^^^^^
.. autoclass:: FB15k237
    :members:

WN18
^^^^
.. autoclass:: WN18
    :members:

WN18RR
^^^^^^
.. autoclass:: WN18RR
    :members:

Hetionet
^^^^^^^^
.. autoclass:: Hetionet
    :members:


Molecule Property Prediction Datasets
-------------------------------------

BACE
^^^^
.. autoclass:: BACE
    :members:

BBBP
^^^^
.. autoclass:: BBBP
    :members:

CEP
^^^
.. autoclass:: CEP
    :members:

ChEMBLFiltered
^^^^^^^^^^^^^^
.. autoclass:: ChEMBLFiltered
    :members:

ClinTox
^^^^^^^
.. autoclass:: ClinTox
    :members:

Delaney
^^^^^^^
.. autoclass:: Delaney
    :members:

FreeSolv
^^^^^^^^
.. autoclass:: FreeSolv
    :members:

HIV
^^^
.. autoclass:: HIV
    :members:

Lipophilicity
^^^^^^^^^^^^^
.. autoclass:: Lipophilicity
    :members:

MUV
^^^
.. autoclass:: MUV
    :members:

Malaria
^^^^^^^
.. autoclass:: Malaria
    :members:

OPV
^^^
.. autoclass:: OPV
    :members:

QM8
^^^
.. autoclass:: QM8
    :members:

QM9
^^^
.. autoclass:: QM9
    :members:

SIDER
^^^^^
.. autoclass:: SIDER
    :members:

Tox21
^^^^^
.. autoclass:: Tox21
    :members:

ToxCast
^^^^^^^
.. autoclass:: ToxCast
    :members:

ZINC250k
^^^^^^^^
.. autoclass:: ZINC250k
    :members:

ZINC2m
^^^^^^
.. autoclass:: ZINC2m
    :members:

MOSES
^^^^^
.. autoclass:: MOSES
    :members:

PCQM4M
^^^^^^
.. autoclass:: PCQM4M
    :members:


Protein Property Prediction Datasets
------------------------------------

BetaLactamase
^^^^^^^^^^^^^
.. autoclass:: BetaLactamase
    :members:

Fluorescence
^^^^^^^^^^^^
.. autoclass:: Fluorescence
    :members:

Stability
^^^^^^^^^
.. autoclass:: Stability
    :members:

Solubility
^^^^^^^^^^
.. autoclass:: Solubility
    :members:

BinaryLocalization
^^^^^^^^^^^^^^^^^^
.. autoclass:: BinaryLocalization
    :members:

SubcellularLocalization
^^^^^^^^^^^^^^^^^^^^^^^
.. autoclass:: SubcellularLocalization
    :members:

EnzymeCommission
^^^^^^^^^^^^^^^^
.. autoclass:: EnzymeCommission
    :members:

GeneOntology
^^^^^^^^^^^^
.. autoclass:: GeneOntology
    :members:

AlphaFoldDB
^^^^^^^^^^^
.. autoclass:: AlphaFoldDB
    :members:

Protein Structure Prediction Datasets
-------------------------------------

Fold
^^^^
.. autoclass:: Fold
    :members:

SecondaryStructure
^^^^^^^^^^^^^^^^^^
.. autoclass:: SecondaryStructure
    :members:

ProteinNet
^^^^^^^^^^
.. autoclass:: ProteinNet
    :members:

Protein-Protein Prediction Datasets
-----------------------------------

HumanPPI
^^^^^^^^
.. autoclass:: HumanPPI
    :members:

YeastPPI
^^^^^^^^
.. autoclass:: YeastPPI
    :members:

PPIAffinity
^^^^^^^^^^^
.. autoclass:: PPIAffinity
    :members:

Protein Ligand Prediction Datasets
----------------------------------

BindingDB
^^^^^^^^^
.. autoclass:: BindingDB
    :members:

PDBBind
^^^^^^^
.. autoclass:: PDBBind
    :members:

Retrosynthesis Datasets
-----------------------

USPTO50k
^^^^^^^^
.. autoclass:: USPTO50k
    :members:


Citation Network Datasets
-------------------------

Cora
^^^^
.. autoclass:: Cora
    :members:

CiteSeer
^^^^^^^^
.. autoclass:: CiteSeer
    :members:

PubMed
^^^^^^
.. autoclass:: PubMed
    :members: