Results 291 to 300 of about 617,908 (340)

Evans-Polanyi-like Formulations for Rapidly Predicting Key Depolymerization Barriers in Xylopyranoses: Toward the Faster Development of Kinetic Models for Hemicellulose Pyrolysis. [PDF]

J Phys Chem A
Ayarde-Henríquez L, Lupi J, Ballotta B, Dooley S.   +3 more
europepmc   +1 more source

Interfacial Interaction‐Mediated Regulation of Metal Oxidation States for Enhanced CO2 Reduction

Advanced Functional Materials, EarlyView.
A hybrid strategy is employed to optimize bismuth–oxygen interactions, precisely regulating interfacial bismuth–oxygen bonds during topochemical synthesis. This leads to vanadium oxynitride‐bismuth catalyst exhibiting high Faradaic efficiency and durability for formate production, attributed to enhanced reaction thermodynamics and kinetics.
Zhongyuan Ma, Cheng Lin, Hyug Hee Han, Youn‐Sang Bae, Kug‐Seung Lee, Kan Zhang, Jong Hyeok Park   +6 more
wiley   +1 more source

Prediction of Automotive Wire Harness Aging Based on CNN-biLSTM-Attention. [PDF]

Sensors (Basel)
Xia K, Zhu Q, Yuan Q, Wang J.
europepmc   +1 more source

Automated Pynta-Based Curriculum for ML-Accelerated Calculation of Transition States. [PDF]

J Phys Chem C Nanomater Interfaces
Price T, Sivakumar S, Johnson MS, Zádor J, Kulkarni A.   +4 more
europepmc   +1 more source

Predicting the Rate Structure of an Evolved Metabolic Network. [PDF]

Metabolites
Srienc F, Barrett J.
europepmc   +1 more source

Hawkes Process Modelling for Chemical Reaction Networks in a Random Environment

Mark Sinzger-D’Angelo, Jan Hasenauer, Heinz Koeppl   +2 more
openalex   +1 more source

Towards global reaction feasibility and robustness prediction with high throughput data and bayesian deep learning. [PDF]

Nat Commun
Zhong H, Liu Y, Sun H, Liu Y, Zhang R, Li B, Yang Y, Huang Y, Yang F, Mak FS, Foo K, Lin S, Yu T, Wang P, Wang X.   +14 more
europepmc   +1 more source

Physics-Informed Neural Networks in Polymers: A Review. [PDF]

Polymers (Basel)
Malashin I, Tynchenko V, Gantimurov A, Nelyub V, Borodulin A.   +4 more
europepmc   +1 more source

Identify structures underlying out-of-equilibrium reaction networks with random graph analysis. [PDF]

Chem Sci
da Cunha ÉF, Kraakman YJ, Kriukov DV, van Poppel T, Stegehuis C, Wong ASY.   +5 more
europepmc   +1 more source

Using thiol-ene click chemistry to engineer 3D printed plasmonic hydrogel scaffolds for SERS biosensing.

Biomater Sci
Troncoso-Afonso L, Henríquez-Banegas YM, Vinnacombe-Willson GA, Gutierrez J, Gallastegui G, Liz-Marzán LM, García-Astrain C.   +6 more
europepmc   +1 more source