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Deep Confident Steps to New Pockets: Strategies for Docking Generalization.
Gabriele Corso
Arthur Deng
Benjamin Fry
Nicholas Polizzi
Regina Barzilay
Tommi S. Jaakkola
Published in:
CoRR (2024)
Keyphrases
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knowledge base
databases
artificial intelligence
image processing
search strategies
similarity measure
bayesian networks
multi class
optimal strategy