Results 131 to 140 of about 4,909,083 (351)

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

open access: yesAdvanced 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   +7 more
wiley   +1 more source

Sensor-Oriented Framework for Underwater Acoustic Signal Classification Using EMD–Wavelet Filtering and Bayesian-Optimized Random Forest

open access: yesSensors
Ship acoustic signal classification is essential for vessel identification, underwater navigation, and maritime security. Traditional methods struggle with the non-stationary nature and noise of ship acoustic signals, reducing classification accuracy. To
Sergii Babichev   +4 more
doaj   +1 more source

Efficient Rollout Strategies for Bayesian Optimization [PDF]

open access: green, 2020
Eric Hans Lee   +4 more
openalex   +1 more source

Transient Antiskyrmion‐Mediated Topological Transitions in Isotropic Magnets

open access: yesAdvanced 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   +18 more
wiley   +1 more source

Temperature prediction model for coal spontaneous combustion based on Bayesian optimization support vector regression

open access: yesGong-kuang zidonghua
To address the issue that traditional coal spontaneous combustion temperature prediction models do not consider multicollinearity between indicator gases and temperature data and have insufficient prediction accuracy, a coal spontaneous combustion ...
YANG Haiyan   +3 more
doaj   +1 more source

Bayesian Optimization For Choice Data [PDF]

open access: gold, 2023
Alessio Benavoli   +2 more
openalex   +1 more source

Determination of the Exchange Current Density at Lithium │ Polymer Electrolyte Interfaces

open access: yesAdvanced Science, EarlyView.
This work presents a comprehensively validated method to determine the exchange current density (j0) at the interface of lithium metal and polymer electrolytes by combining electrochemical impedance spectroscopy with Bayesian inference and distribution of relaxation times analyses to successfully deconvolute solid electrolyte interphase and charge ...
Katrin Geng   +4 more
wiley   +1 more source

Comparison of N-BEATS with Standalone and Hybrid Deep Learning Models in Monthly Inflow Forecasting to the Aras Dam Reservoir: A Feature Selection Analysis

open access: yesJournal of Agricultural Sciences
Reservoir dams play a pivotal role in water resource management. Accurate prediction of inflow to reservoirs significantly enhances operational performance.
Elman Athari   +2 more
doaj   +1 more source

Preferential Bayesian Optimization

open access: yes, 2017
Bayesian optimization (BO) has emerged during the last few years as an effective approach to optimizing black-box functions where direct queries of the objective are expensive. In this paper we consider the case where direct access to the function is not possible, but information about user preferences is.
Gonzalez, Javier   +3 more
openaire   +2 more sources

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