"De novo design and bioactivity prediction of mitotic kinesin Eg5 ..."

Damilola S. Bodun et al. (2025)

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DOI: 10.1016/J.COMPBIOMED.2025.110672

access: closed

type: Journal Article

metadata version: 2025-08-09

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Damilola S. Bodun, Isiaka O. Ibrahim, Mujeebat Bashiru, Rachael Oluwakamiye Abolade, Wilberforce K. Ndarawit, Adedoyin John-Joy Owolade, Temitope A. Ogunnupebi, Ibeh John Somtochukwu, Ezekiel A. Olugbogi, Katukoliya Gamage Anuththara Samadhi, Gbolahan O. Oduselu, Suliman Sharif, Damilola A. Omoboyowa, Olayinka O. Ajani:
De novo design and bioactivity prediction of mitotic kinesin Eg5 inhibitors using MPNN and LSTM-based transfer learning. Comput. Biol. Medicine 195: 110672 (2025)

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