Common neural community potentials as descriptors: Against scalable chemical belongings prediction the use of quantum and classical computer systems

Digital Discovery, 2024, Accepted Manuscript
DOI: 10.1039/D4DD00098F, Paper

Open Access

&nbsp This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.

Tomoya Shiota, Kenji Ishihara, Wataru Mizukami
Accurate prediction of diverse chemical properties is crucial for advancing molecular design and materials discovery. Here we present a versatile approach that uses the intermediate information of a universal neural…
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