MARCH 26, 2025 Journal Article FREDA: A web application for the processing, analysis, and visualization of Fourier-transform mass spectrometry data ( Read More )
MARCH 14, 2025 Journal Article Chemical Information From XPS: Theory and Experiment For Ni(OH)2 ( Read More )
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MARCH 5, 2025 Journal Article CaXML: Chemistry-informed Machine Learning Explains Mutual Changes between Protein Conformations and Calcium Ions in Calcium-binding Proteins Using Structural and Topological Features ( Read More )
FEBRUARY 26, 2025 Journal Article Metal–Ligand Covalency in the Valence Excited States of Metal Dithiolenes Revealed by S 1s3p Resonant Inelastic X-ray Scattering ( Read More )
FEBRUARY 14, 2025 Journal Article Optical Extinction-Based 3D Nano-Imaging of WS2 on Gold ( Read More )
FEBRUARY 12, 2025 Journal Article Spectral Analysis and Kinetic Modeling of Radioluminescence in Air and Nitrogen ( Read More )
FEBRUARY 7, 2025 Journal Article Ligand Substituent Effects on the Electronic Properties of Lindqvist-Type Polyoxometalate Multi-Level-Switches in the Gas Phase, Solution and on Surfaces ( Read More )
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JANUARY 15, 2025 Journal Article WFOT: a Wave Function Overlap Tool Between Single- and Multi-Reference Electronic Structure Methods for spectroscopy Simulation ( Read More )
JANUARY 8, 2025 Journal Article Artificial Intelligence Transforming Post-Translational Modification Research ( Read More )
JANUARY 7, 2025 Journal Article Tunable Localized Charge Transfer Excitons in Nanoplatelet-2D chalcogenide van der Waals Heterostructures ( Read More )
DECEMBER 27, 2024 Journal Article Improved Enzyme Functional Annotation Prediction Using Contrastive Learning with Structural Inference ( Read More )
DECEMBER 24, 2024 Journal Article Smaller is better: The case for lower-order iodoplumbate species dominating MAPbI3/dimethylformamide solutions ( Read More )
DECEMBER 24, 2024 Journal Article Crystallization and Assembly at Interfaces: Celebrating the Achievements of a Vibrant Research Community ( Read More )
DECEMBER 21, 2024 Journal Article Protein-Protein Interaction Networks Derived from Classical and Machine Learning-Based Natural Language Processing Tools ( Read More )