Optimal Transport Based Graph Kernels for Drug Property Prediction
<italic>Objective:</italic> The development of pharmaceutical agents relies heavily on optimizing their pharmacodynamics, pharmacokinetics, and toxicological properties, collectively known as ADMET (Absorption, Distribution, Metabolism, Excretion, and Toxicity). Accurate assessment of th...
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Main Authors: | , |
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Format: | Article |
Language: | English |
Published: |
IEEE
2025-01-01
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Series: | IEEE Open Journal of Engineering in Medicine and Biology |
Subjects: | |
Online Access: | https://ieeexplore.ieee.org/document/10716457/ |
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