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- Mn–Co/MIL-100(Fe) nanocomposite for pseudocapacitive energy storage and adsorptive removal of malachite green dye
- Au/GQD hybrid interfaces: signal-transduction principles and evidence for metal-ion sensing
- DprE1 inhibitors in tuberculosis: integrating structural binding determinants, IC50–MIC translation, and physicochemical constraints for rational drug design
- Non-fluorinated phosphonium-sulfonate ionic liquids as candidates for thermally demanding applications: thermal stability, viscosity and liquid-state temperature ranges
- Dual‐Target Repurposing Against Chikungunya Virus: Molecular Docking and Dynamics Reveal Bictegravir and Oxacillin as Promising Leads
- Interfacial H relay and site regeneration in Mn single atom-Ru cluster hybrids for efficient alkaline HER
- Sunlight-driven removal of tetracycline over l-histidine–MgO–AgI composites: synthesis, morphological insight, and enhanced thermal stability
- Illuminating metabolic disorders with engineered fluorescent carbon dots: advances in biosensing to therapeutics
- Probing the H-bonding features in [2.2.2]-cryptand/KF and permethylated β-cyclodextrin/KF complexed with protonated amino acids by 19F-NMR/IRMPD spectroscopy
- Catechol-functionalized carbon nanofibers enabling ultrafine CoFe2O4 nanorods for high-performance bifunctional oxygen electrocatalysis and Zn–air batteries
- Effective control of the ferromagnetism and magnetic anisotropy in MoSeTe monolayer doped with transition metals through charge carrier doping
- A Versatile Method for Determination of Resin Acids in Occupational Softwood Sawmill Dust Samples by Liquid Chromatography‐Atmospheric Pressure Chemical Ionization‐Mass Spectrometry
- Multireference perturbation theory with nonorthogonal determinants
- Formamide formation on forsterite and Mg(OH)2·H2O
- Context-Aware Automated NMR Structure Elucidation
- Les céramiques avancées : de la chimie des matériaux aux applications stratégiques
- Lipid and Carbohydrate Modifications Enhance Potency of Antisense Oligonucleotides Targeting Oncogenic KRAS
- When optimized geometries are not optimal: Implications for inverted singlet-triplet gap predictions
- Open-shell Configuration State Functions as trial states for phaseless auxiliary-field quantum Monte Carlo
- Machine Learning the Complete Active-Space Wavefunction Reconstruction
- Explicit pore pre-conditioning and inverse design of amorphous nanoporous carbon
- Unraveling Primary Energy Conversion Dynamics in Intact Cells of Gemmatimonas groenlandica
- Brueckner Orbitals in Local Pair Natural Orbital Coupled-Cluster Theory: DLPNO-BCCD(T) and DLPNO-BCCD(T)_Lambda2
- Thermodynamics-Informed Learning Captures Hierarchical Hydrogen-Bond Networks in Deep Eutectic Solvents
- Exact periodic electrostatics for latent-charge machine-learning potentials