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Evaluation of machine learning models for the accelerated prediction of density functional theory calculated 19F chemical shifts based on local atomic environments by Sophia Li, Emma Wang, Leia Pei, Sourodeep Deb, Prashanth Prabhala, Sai Hruday Reddy Nara, Raina Panda, Shiven Eltepu, Marx Akl, Larry McMahan, Edward Njoo
Published 2024-12-01Get full text
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