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Virtual screening of DrugBank database for hERG blockers using topological Laplacian-assisted AI models.

, and . Comput. Biol. Medicine, (February 2023)

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Multi-objective Molecular Optimization for Opioid Use Disorder Treatment Using Generative Network Complex., , , and . CoRR, (2023)A fourth order finite difference method for solving elliptic interface problems with the FFT acceleration., and . J. Comput. Phys., (2020)Virtual screening of DrugBank database for hERG blockers using topological Laplacian-assisted AI models., and . Comput. Biol. Medicine, (February 2023)ChatGPT in Drug Discovery: A Case Study on Anticocaine Addiction Drug Development with Chatbots., , and . J. Chem. Inf. Model., 63 (22): 7189-7209 (November 2023)FFT-based high order central difference schemes for three-dimensional Poisson's equation with various types of boundary conditions., and . J. Comput. Phys., (2020)A FFT accelerated high order finite difference method for elliptic boundary value problems over irregular domains., , and . J. Comput. Phys., (2022)An augmented matched interface and boundary (MIB) method for solving elliptic interface problem., , and . J. Comput. Appl. Math., (2019)Machine-learning analysis of opioid use disorder informed by MOR, DOR, KOR, NOR and ZOR-based interactome networks., , , and . Comput. Biol. Medicine, (May 2023)Machine-learning repurposing of DrugBank compounds for opioid use disorder., , and . Comput. Biol. Medicine, (June 2023)TIDAL: Topology-Inferred Drug Addiction Learning., , , , , , , , , and 1 other author(s). J. Chem. Inf. Model., 63 (5): 1472-1489 (March 2023)