OCTOBER 12, 2024 Report Multi-scale Simulation, Calibration, and Optimization of Calcium Carbonate Precipitation in Microbial Communities ( Read More )
SEPTEMBER 20, 2024 Journal Article Deciphering the Cofilin Oligomers via Intermolecular Disulfide Bond Formation: A Coarse-grained Molecular Dynamics Approach to Understanding Cofilin’s Regulation on Actin Filaments ( Read More )
SEPTEMBER 19, 2024 Journal Article Four Vignettes on Interactions with Martin Seah: The Impact of His Work ( Read More )
SEPTEMBER 19, 2024 Journal Article IsoForma: An R Package for Quantifying and Visualizing Positional Isomers in Top-Down LC-MS/MS Data ( Read More )
SEPTEMBER 19, 2024 Journal Article Ni and Co Incorporation in Forsterite: A Density Functional Theory Study with Hubbard Correction ( Read More )
SEPTEMBER 19, 2024 Journal Article Driving forces for particle-based crystallization: from experiments to theory and simulations ( Read More )
SEPTEMBER 19, 2024 Journal Article QC-GN2oMS2: a Graph Neural Net for High Resolution Mass Spectra Prediction ( Read More )
SEPTEMBER 19, 2024 Journal Article Role of dynamic polarization interactions in the electrical double layer at calcite (104) interfaces with aqueous solutions ( Read More )
AUGUST 6, 2024 Conference Paper A Deep Multimodal Representation Learning Framework for Accurate Molecular Properties Prediction ( Read More )
AUGUST 4, 2024 Journal Article Characterizing the Microstructures of Mammalian Enamel by Synchrotron Phase Contrast microCT ( Read More )
AUGUST 1, 2024 Journal Article Developmental ethanol exposure impacts Purkinje cells but not microglia in the young adult cerebellum. ( Read More )
JULY 31, 2024 Journal Article Computational tools and algorithms for ion mobility spectrometry-mass spectrometry ( Read More )
JULY 26, 2024 Journal Article Mechanisms of Dissolution from Gibbsite Step Edges Elucidated by Ab Initio Molecular Dynamics with Enhanced Sampling ( Read More )
JULY 26, 2024 Journal Article Role of Surface Features on the Initial Dissolution of CH3NH3PbI3 Perovskite in Liquid Water: An Ab Initio Molecular Dynamics Study ( Read More )
JULY 26, 2024 Journal Article Influence of Peptoid Sequence on the Mechanisms and Kinetics of 2D Assembly ( Read More )
JULY 26, 2024 Journal Article An Approach to Learn Regulation to Maximize Growth and Entropy Production Rates in Metabolism ( Read More )
JULY 26, 2024 Journal Article Computational and Systems Biology Advances to Enable Bioagent Agnostic Signatures ( Read More )
JULY 26, 2024 Journal Article Decomprolute is a benchmarking platform designed for multiomics-based tumor deconvolution ( Read More )