Physical chemistry
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- SpecTUS: Spectral Translator for Unknown Structures Annotation from EI-MS Spectra
- Integrative structural interactomics reveals protein organization and structure in a giant virus
- Quantitative Analysis of Exciton Composition and Dynamics in Y6 Films for Single-Component Solar Cells
- Ultrasound-assisted extraction of flavonoids from Artemisia argyi folium using deep eutectic solvents: optimization, mechanistic characterization, bioactivity evaluation, and strawberry preservation applications
- Tesorai Search: Cloud-based Database Search Engine Boosts Identifications for Mass Spectrometry Proteomics With a Pretrained Peptide-spectrum Deep-learning Model
- Molecular interpretability of the bulk electrochemical impedance of concentrated electrolytes
- Acoustic wave speed in aerogels across material classes: density scaling from theory and experiments
- CVD‑engineered silver nanoparticle substrates for matrix‑free LDI‑MS analysis of diesel fuel components
- Exploring the photodynamical landscape of biomimetic lumichrome–ephedrine-class amine complexes across femtosecond to millisecond regimes
- Modern Optimization Strategies in High‐Performance Liquid Chromatography Analysis
- Foundation model enables interpretable open and error-tolerant searching for mass spectrometry-based proteomics
- Real-time simulation of charge migration within the time-dependent Kohn-Sham DFT
- Towards Generalizable and Evidential Nuclear Magnetic Resonance-Based Molecular Structure Elucidation via Large Language Model Agent
- High-speed and high-sensitivity multi-gas detection based on parallel heterodyne LITES sensor
- Extension of openCOSMO-RS Into a Full Open-Source Equation of State: Implementation, Parameterization, and Benchmarking
- Photophysical behavior of mono- and bis(2′-hydroxyphenyl)-6-(4′-diphenylaminophenyl)pyrimidines: Interplay of ESIPT, ICT, and vibrational nonradiative decay
- Beyond BET: Two-dimensional thermodynamic modeling of adsorption for specific surface area determination
- Systematic characterisation of site-specific proline hydroxylation using hydrophilic interaction chromatography and mass spectrometry
- Electrochemical Electron Transfer: Key Concepts, Theories, and Parameterization via Atomistic Simulations
- Intelligent Algorithm-Assisted Indirect Absorption Spectroscopy for Trace Gas Sensing
- Mapping mRNA Localization and Internal Structure in Lipid Nanoparticles through Solid‐State Dynamic Nuclear Polarization NMR and Proton Spin‐Diffusion Modeling
- Integration of STEM technologies in chemistry education: opportunities, challenges, and future directions
- Azaullazine-driven frontier orbital engineering enables nanosecond-lived singlet MLCT states in Fe(II) NHC complexes
- Switching Between ILCT and 3MLCT Excited States by Complex Formation in Ruthenium–Polypyridine Complex Containing Thiacrown-Ether Unit
- Hyperpolarization of [1‐ 13 C]Ketoisocaproate‐d 2 by Reversible Exchange with Parahydrogen Enables Profiling of Branched‐Chain‐Amino‐Acid Metabolism in Cellulo and in Vivo