‪Blake B. Gaines‬ - ‪Google Scholar‬

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Blake B. Gaines

Blake B. Gaines

University of Connecticut

Verified email at uconn.edu

Machine Learning Data Mining Bioinformatics Computational Chemistry Natural Language Processing


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OctSurf: Efficient hierarchical voxel-based molecular surface representation for protein-ligand affinity prediction Q Liu, PS Wang, C Zhu, BB Gaines, T Zhu, J Bi, M Song Journal of Molecular Graphics and Modelling 105, 107865, 2021	29	2021
Fragment‐based deep molecular generation using hierarchical chemical graph representation and multi‐resolution graph variational autoencoder Z Gao, X Wang, B Blumenfeld Gaines, X Shi, J Bi, M Song Molecular Informatics 42 (5), 2200215, 2023	4*	2023
Mining Large-Scale Knowledge Graphs for Chemical Reaction Fingerprints BB Gaines, M Song, J Bi 2023 IEEE International Conference on Big Data (BigData), 510-515, 2023		2023

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