Application of Generative Artificial Intelligence in Predicting Membrane Partitioning of Drugs: Combining Denoising Diffusion Probabilistic Models and MD Simulations Reduces the Computational Cost to One-Third - Githubissues

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Application of Generative Artificial Intelligence in Predicting Membrane Partitioning of Drugs: Combining Denoising Diffusion Probabilistic Models and MD Simulations Reduces the Computational Cost to One-Third #129

Open kntkb opened 4 months ago

kntkb commented 4 months ago

https://pubs.acs.org/doi/10.1021/acs.jctc.4c00315