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Turbocharging protein binding site prediction with geometric attention, inter-resolution transfer learning, and homology-based augmentation | BMC Bioinformatics

Fig. 2This figure illustrates the architectures of our BRI and BSD modules and the training procedure. The roles of these modules within the prediction procedure are explained...

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Mechanistic templates computed for the Grubbs alkene-metathesis reaction.

Mechanistic templates computed for the Grubbs alkene-metathesis reaction. Following on from my template exploration of the Wilkinson hydrogenation catalyst, I now repeat this for the...

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