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"DeepCOMO: from structure-activity relationship diagnostics to generative ..."

Dimitar G. Yonchev, Jürgen Bajorath (2020)

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DOI: 10.1007/S10822-020-00349-3

access: open

type: Journal Article

metadata version: 2023-09-30

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  - journals/jcamd/YonchevB20
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  - https://dblp.org/rec/journals/jcamd/YonchevB20
Dimitar G. Yonchev, Jürgen Bajorath:
DeepCOMO: from structure-activity relationship diagnostics to generative molecular design using the compound optimization monitor methodology. J. Comput. Aided Mol. Des. 34(12): 1207-1218 (2020)

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