Results 231 to 240 of about 846,338 (367)

Design of Single‐Atom Catalysts Anchored in N‐Doped Biphenylene Using Symbolic Regression for Electrocatalytic Nitrate Reduction to Ammonia

Advanced Science, EarlyView.
A high‐throughput in silico calculations for NO3RR based on transition metal doped and nitrogen decorated biphenylene network are performed. A symbolic regression is designed to capture the hidden descriptors of NO3RR for hyper dimensional system entailing large geometric variability.
Zheng Shu, Zhangsheng Shi, Huaxian Jia, Huifang Xu, Zian Xu, Zhongheng Li, Man‐Fai Ng, Teck Leong Tan, Fuqiang Huang, Yongqing Cai   +9 more
wiley   +1 more source

Exploring entropy measures in polymer graphs using logarithmic regression model. [PDF]

Sci Rep
Irfan M, Younis J, Altassan A, Alfwzan WF, Bashir N, Alharbi NT.   +5 more
europepmc   +1 more source

Topologically twisted index in the ’t Hooft limit and the dual AdS4 black hole entropy [PDF]

, 2019
Leopoldo A. Pando Zayas, Yu Xin
openalex   +1 more source

DualPG‐DTA: A Large Language Model‐Powered Graph Neural Network Framework for Enhanced Drug‐Target Affinity Prediction and Discovery of Novel CDK9 Inhibitors Exhibiting in Vivo Anti‐Leukemia Activity

Advanced Science, EarlyView.
This study introduces DualPG‐DTA, a framework integrating two pre‐trained models to generate molecular and protein representations. It constructs dual graphs processed by specialized neural networks with dynamic attention for feature fusion, achieving superior benchmark performance.
Yihao Chen, Jindi Huang, Cong Liu, Shipeng Zhang, Xinze Li, Zhang Zhang, Tie‐Gen Chen, Ling Wang   +7 more
wiley   +1 more source

Alterations in Multidimensional Functional Connectivity Architecture in Preschool Children with Autism Spectrum Disorder. [PDF]

Brain Sci
Kang J, Zhang X, Xiao Z, Fan Z, Li X, Zhou T, Chen H.   +6 more
europepmc   +1 more source

Topological conditional entropy [PDF]

Studia Mathematica, 1976
openaire   +2 more sources

Recurrence and topological entropy of translation operators

, 2018
Zongbin Yin, Yongchang Wei
semanticscholar   +1 more source

Transient Antiskyrmion‐Mediated Topological Transitions in Isotropic Magnets

Advanced Science, EarlyView.
A transient antiskyrmion‐mediated pathway that drives repeated stripe‐to‐skyrmion transitions is revealed, producing a net increase in topological charge in isotropic Dzyaloshinskii–Moriya interaction films. Experiments and simulations identify the antiskyrmion as a metastable excitation, enabling stochastic bitstream generation for probabilistic ...
Bingqian Dai, Tianyi Wang, Albert Lee, Shijie Xu, Zhongjian Bian, Xinyue Zhu, Puyang Huang, Aadi Chaturvedi, Yaochen Li, Yang Cheng, Qingyuan Shu, Haoran He, Hanshen Huang, Lixuan Tai, Kin Wong, Jinbo Yang, Anjan Soumyanarayanan, Zhaochu Luo, Kang L. Wang   +18 more
wiley   +1 more source

From bound states to quantum spin models: chiral coherent dynamics in topological photonic rings. [PDF]

Nanophotonics
Davoodi F.
europepmc   +1 more source

A new topological entropy-based approach for measuring similarities among piecewise linear functions

, 2015
Matteo Rucco, Rocı́o González-Dı́az, María-José Jiménez, Nieves Atienza, Cristina Cristalli, Enrico Concettoni, Andrea Ferrante, Emanuela Merelli   +7 more
openalex   +1 more source