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BACH, a Bayesian Optimization Protocol for Accurate Coarse‐Grained Parameterization of Organic Liquids

open access: yesAdvanced Functional Materials, EarlyView.
We present a fully automated Bayesian optimization (BO) protocol for the parameterization of nonbonded interactions in coarse‐grain CG force fields (BACH). Using experimental thermophysical data, we apply the protocol to a broad range of liquids, spanning linear, branched, and unsaturated hydrocarbons, esters, triglycerides, and water.
Janak Prabhu   +3 more
wiley   +1 more source

LLM-Enhanced multimodal detection of fake news. [PDF]

open access: yesPLoS One
Wang J, Zhu Z, Liu C, Li R, Wu X.
europepmc   +1 more source

Dual stream graph augmented transformer model integrating BERT and GNNs for context aware fake news detection. [PDF]

open access: yesSci Rep
Rama Moorthy H   +6 more
europepmc   +1 more source

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