Advanced Science, EarlyView.MolDBG is a site‐aware, sequence‐only framework that unifies drug‐target affinity prediction, binding‐site identification, and affinity‐conditioned molecular generation for structured proteins. Guided by multi‐task binding‐site supervision, it aligns interaction‐critical residues before learning drug‐target representations and simultaneously infers ...
Gang Luo +6 more
wiley +1 more source
Bio-Inspired Metaheuristic Optimization of a DWT-BiLSTM Architecture for Wind Speed Forecasting: A Statistical Benchmark with Component Ablation. [PDF]
Biomimetics (Basel)Bendeş E.
europepmc +1 more source
Advanced Science, EarlyView.STWave transforms massive microscopic‐resolution spatial transcriptomics into interpretable fine‐scale tissue maps through patch‐wise inference, wavelet‐based multi‐scale encoding, and dual‐domain reconstruction. It reduces noise while preserving weak spatial signals, enabling efficient analysis of 6 40 000 spots of 2.47 GB GPU memory and revealing ...
Tao Jiang +9 more
wiley +1 more source
Modeling and optimization of hydrogenation for crude oil by estimating hydrogen solubility in the solvent at different temperatures. [PDF]
Front ChemZhao Z.
europepmc +1 more source
Advanced Science, EarlyView.A unified time‐series forecasting framework learns transferable battery capacity‐degradation patterns from 20 heterogeneous datasets spanning chemistries, formats, temperatures, and cycling conditions. A single model delivers competitive predictions on both known and previously unseen datasets, while physics‐guided representation learning improves ...
Joey Chan +8 more
wiley +1 more source
Prediction model for compressive strength of alkali-activated multi-source solid-waste grouting materials based on generative adversarial networks and machine learning. [PDF]
PLoS OneYue Q +6 more
europepmc +1 more source
Mesoporous‐Shell Monolayer Plasmonic Architecture Enables Quantitative and Decision‐Guided SERS
Advanced Science, EarlyView.Mesoporous‐shell‐regulated molecular transport combined with monolayer hotspot determinism transforms surface‐enhanced Raman spectroscopy (SERS) from ultrasensitive detection into quantitative and decision‐guided molecular sensing. ABSTRACT Quantitative surface‐enhanced Raman spectroscopy (SERS) has long been impeded by stochastic hotspot formation ...
Guangyao Huang +9 more
wiley +1 more source
Vehicle CO₂ emission prediction based on firefly with ant colony optimization tuned long short-term memory model. [PDF]
Sci RepAbbas S +5 more
europepmc +1 more source
NICE: A Two‐Step Non‐Invasive Framework for Embryo cfDNA Read Enrichment and Quality Assessment
Advanced Science, EarlyView.The non‐invasive NICE framework, built on an ensemble stacking machine learning model, prioritizes embryos by analyzing cell‐free DNA from spent culture medium. By integrating multimodal signals, including genomic and epigenetic profiles, this automated approach standardizes morphological assessment without human bias, paving the way for more precise ...
Xueya Zhou +6 more
wiley +1 more source
Enhancing Road Sensor Data Fidelity via FMD Decomposition for Accurate Traffic Flow Prediction Using EBWO-Optimized LGC-BiGRU. [PDF]
Sensors (Basel)Jiang J +3 more
europepmc +1 more source