https://link.springer.com/article/10.1186/s40643-022-00546-y?error=cookies_not_supported&code=5f7f4034-ea54-47fe-b333-109240a49279
May 13, 2022 - Although current computational biology software is available and has prompted the development of enzyme–substrates simulation, they are difficult to
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https://www.elsevier.com/books-and-journals/book-series/methods-in-molecular-and-materials-modelling
Molecular modelling methods are now indispensable tools in chemical, materials, and biomolecular sciences.
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https://www.graphcore.ai/posts/graphcore-helps-pnnl-accelerate-3d-molecular-modelling-with-gnns
Work by PNNL and Graphcore could be applied to a wide range of applications, from drug discovery to developing more efficient solar panels.
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