Chemical Design - Groups

MOSES dataset

The dataset used for testing the performance of the deep generative model.

Dataset
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ZINC-ﬁltered dataset

The dataset used for training a deep generative model to design novel photo-acid generators.

Dataset
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Automatic Chemical Design Using a Data-Driven Continuous Representation of Mo...

A dataset for automatic chemical design using a data-driven continuous representation of molecules.

Dataset
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ZINC250K

The ZINC250K dataset is a large dataset of molecules used for molecular design and generation. It contains 250,000 molecules with their corresponding properties and structures.

Dataset
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4 datasets found

MOSES dataset

ZINC-ﬁltered dataset

Automatic Chemical Design Using a Data-Driven Continuous Representation of Mo...

ZINC250K