SEPTEMBER 30, 2026 Journal Article H2X100: A Gold-Standard CCSD(T)/CBS Benchmark Dataset of Binding Energies, Structures, and Harmonic Frequencies for (H2X)n, X = S, Se, Te, n = 2 – 4, and Assessment of Lower-Scaling Density Functional Theory Methods ( Read More )
SEPTEMBER 22, 2026 Journal Article MixPI: Mixed-Time Slicing Path Integral Software for Quantized Molecular Dynamics Simulations ( Read More )
SEPTEMBER 22, 2026 Journal Article Comparative Analysis of Report-Back of Research Results Strategies for Personal Chemical Exposure Data ( Read More )
SEPTEMBER 22, 2026 Journal Article Aggregation methods for quantifying PTM and structural changes in bottom-up proteomics ( Read More )
SEPTEMBER 22, 2026 Journal Article spammR: an R package designed for analysis and integration of spatial multi-omic measurements ( Read More )
SEPTEMBER 22, 2026 Journal Article Host analysis-guided selection and targeted engineering (HASTE) of Lipomyces tetrasporus for the conversion of CO2-derived feedstocks ( Read More )
SEPTEMBER 22, 2026 Journal Article Graph Identification of Proteins in Tomograms (GRIP-Tomo) 2.0: Topologically aware classification for proteins ( Read More )
SEPTEMBER 22, 2026 Journal Article Personal and environmental predictors of polycyclic aromatic hydrocarbon exposure identified through repeated silicone wristband sampling ( Read More )
SEPTEMBER 22, 2026 Journal Article Deconstructing Chirality: Probing Local and Nonlocal Effects in Azobenzene Derivatives with X-ray Circular Dichroism ( Read More )
SEPTEMBER 22, 2026 Journal Article Molecular modelling of surfactant interaction on phospholipid bilayers mimicking corneal epithelium ( Read More )
SEPTEMBER 22, 2026 Journal Article OmicsMLMentor: A Web Application for Guided Machine Learning Analysis of Omics Data ( Read More )
SEPTEMBER 22, 2026 Report EcoKMER: One-stop shop for spatio-temporal metagenomic exploration using DataFed ( Read More )
SEPTEMBER 22, 2026 Journal Article Spatiotemporal 4D Whole-cell Modeling of a Minimal Autotroph Reveals Central Carbon Metabolism Regulated Locally by Protein Megacomplexes via Post-translational Modifications under Light Disturbance ( Read More )
SEPTEMBER 22, 2026 Journal Article Fingerprinting Uranium Oxides with Electron Energy Loss Spectroscopy Supported by Theoretical Computations ( Read More )
SEPTEMBER 22, 2026 Journal Article Fermionic mean-field dynamics for spin systems beyond free fermions ( Read More )
SEPTEMBER 22, 2026 Journal Article A Cautionary Tale: Failure of the Valence CASSCF to Describe the Hallmark of Hydrogen Bonding ( Read More )
SEPTEMBER 22, 2026 Report NW-BRaVE T3 Hydroplane Project Close: Project Close-out for T3 Hydroplane Analysis ( Read More )
SEPTEMBER 22, 2026 Report Thermodynamics of Tritium Trapping by Point Defects at Interfacial Cr-based Phases of the Al Coating ( Read More )
SEPTEMBER 22, 2026 Report Attributing Economic Value and Reliability Benefits from Large Cascading Hydro Systems Coordinated Under Normal and Extreme Weather Events, and the Incremental Values of Pumped Storage (CRADA 717) Abstract ( Read More )