SEPTEMBER 19, 2024 Journal Article QC-GN2oMS2: a Graph Neural Net for High Resolution Mass Spectra Prediction ( 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 )
AUGUST 6, 2024 Conference Paper A Deep Multimodal Representation Learning Framework for Accurate Molecular Properties Prediction ( 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 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 Decrease in multiple complement protein levels associated with development of islet autoimmunity and type 1 diabetes ( Read More )
JULY 26, 2024 Journal Article Decomprolute is a benchmarking platform designed for multiomics-based tumor deconvolution ( Read More )
JULY 26, 2024 Journal Article Probabilistic and Maximum Entropy Modeling of Chemical Reaction Systems: Characteristics and Comparisons to Mass Action Kinetic Models ( 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 )
MAY 7, 2024 Conference Paper Expanding the access of wearable silicone wristbands in community-engaged research through best practices in data analysis and integration ( Read More )
APRIL 30, 2024 Conference Paper FASDA: An FPGA-Aided, Scalable and Distributed Accelerator for Range-Limited Molecular Dynamics ( Read More )
APRIL 11, 2024 Journal Article Genome-Scale Model Development and Genomic Sequencing of the Oleaginous Clade Lipomyces ( Read More )
APRIL 3, 2024 Journal Article PTM-Psi: A Python Package to Facilitate the Computational Investigation of Post-Translational Modification on Protein Structures and Their Impacts on Dynamics and Functions ( Read More )
FEBRUARY 17, 2024 Journal Article Ex vivo to in vivo model of malignant peripheral nerve sheath tumors for precision oncology ( Read More )
FEBRUARY 15, 2024 Journal Article Adaptive Ensemble Refinement of Protein Structures in High Resolution Electron Microscopy Density Maps with Radical Augmented Molecular Dynamics Flexible Fitting ( Read More )
FEBRUARY 15, 2024 Journal Article CDK4/6 inhibition enhances SHP2 inhibitor efficacy and is dependent upon RB function in malignant peripheral nerve sheath tumors ( Read More )
FEBRUARY 15, 2024 Journal Article X-ray absorption spectroscopy and theoretical investigations of the effect of extended ligands in potassium organic matter interaction ( Read More )