chemicalchecker.tool
External or experimental tools.
This module encapsulates several tools that the Chemical Checker uses
(e.g. node2vec,
hotnet, etc). The idea is to provide an interface
or wrappers for users to access the main functionalities of these tools.
Very specific project or experimental CC spin-offs can start being submodules
here, e.g. the targetmate.
AdaNet model. |
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HotNet wrapper. |
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Node2vec wrapper. |
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Siamese neural networks. |
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Signature prediction from SMILES. |
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