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Neural network (NN) potentials are a natural choice for coarse-grained (CG) models. Their many-body capacity allows highly accurate approximations of the potential of mean force, promising CG simulations at unprecedented accuracy. CG NN potentials tr
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::1ab129f32cf096480efb96cf8effc784
http://arxiv.org/abs/2208.10330
http://arxiv.org/abs/2208.10330
