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Enumerating common molecular substructures

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68 days ago
Enumerating common molecular substructures https://t.co/sskx99EmSz
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Additional Information

Competing Interests

The authors declare that they have no competing interests.

Author Contributions

Martin S Engler conceived and designed the experiments, performed the experiments, analyzed the data, contributed reagents/materials/analysis tools, wrote the paper, prepared figures and/or tables, reviewed drafts of the paper.

Mohammed El-Kebir contributed reagents/materials/analysis tools, reviewed drafts of the paper.

Jelmer Mulder contributed reagents/materials/analysis tools, reviewed drafts of the paper.

Alan E Mark conceived and designed the experiments, wrote the paper.

Daan P Geerke conceived and designed the experiments, wrote the paper.

Gunnar W Klau conceived and designed the experiments, wrote the paper.

Data Deposition

The following information was supplied regarding data availability:

https://github.com/enitram/mogli.

Funding

This work was supported by the Netherlands eScience center (No. 027.015.G06). The funders had no role in study design, data collection and analysis, decision to publish, or preparation of the manuscript.


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