Lipid Isobar and Isomer Imaging Using Nanospray Desorption Electrospray Ionization Combined with Triple Quadrupole Mass Spectrometry

…, M Yang, H Hu, E Hernly, M Muhoberac… - Analytical …, 2024 - ACS Publications
Mass spectrometry imaging (MSI) is widely used for examining the spatial distributions of
molecules in biological samples. Conventional MSI approaches, in which molecules extracted …

Recent Developments in Machine Learning for Mass Spectrometry

AG Beck, M Muhoberac, CE Randolph… - ACS Measurement …, 2024 - ACS Publications
Statistical analysis and modeling of mass spectrometry (MS) data have a long and rich history
with several modern MS-based applications using statistical and chemometric methods. …

Comprehensive Lipidomic Automation Workflow using Large Language Models

…, S Iyer, CE Randolph, M Muhoberac… - arXiv preprint arXiv …, 2024 - arxiv.org
Lipidomics generates large data that makes manual annotation and interpretation
challenging. Lipid chemical and structural diversity with structural isomers further complicates …

Modeling Molecular Mechanisms of Pirfenidone Interaction with Kinases

P Wijewardhane, A Wells, M Muhoberac, KP Leung… - bioRxiv, 2024 - biorxiv.org
Scar formation is a process that occurs due to increased collagen deposition and
uncontrolled inflammation. Previous studies have demonstrated that Pirfenidone (Pf), an FDA …

DUBS: A Framework for Developing D irectory of U seful B enchmarking S ets for Virtual Screening

J Fine, M Muhoberac, G Fraux… - Journal of chemical …, 2020 - ACS Publications
Benchmarking is a crucial step in evaluating virtual screening methods for drug discovery.
One major issue that arises among benchmarking data sets is a lack of a standardized format …

[CITATION][C] Lemon: a framework for rapidly mining structural information from the protein data bank for the development of virtual screening benchmarking sets

M Muhoberac, C Gaurav, J Fine - American Chemical Society …, 2020 - ACS Publications
The Protein Data Bank (PDB) currently holds over 140 000 biomolecular structures and
continues torelease new structures on a weekly basis. The PDB is an essential resource to the …

Proton to proteome, a multi-scale investigation of drug discovery

JA Fine - 2020 - search.proquest.com
Chemical science spans multiple scales, from a single proton to the collection of proteins
that make up a proteome. Throughout my graduate research career, I have developed …

[BOOK][B] The Black Parade

My Chemical Romance (Musical group)… - 2006 - kuliahnonreguler-jawa-barat.s2-mm …
… Mikey Way mengambil cuti untuk menikah dan digantikan oleh teknisi gitar MCR, Matt
Cortez, sejak 18 April 2007 hingga 4 Oktober 2007. [24] Enam konser dibatalkan pada 29 April …

[BOOK][B] Jazz in New Orleans: The postwar years through 1970

C Suhor - 2001 - books.google.com
… , I have commented often and candidly on matters of race in connection with the settings and
… at LSU-Reed Vaughan, trombonist Larry Muhoberac, and others who continued the modern …

Gradient elution moving boundary electrophoresis for high-throughput multiplexed microfluidic devices

JG Shackman, MS Munson, D Ross - Analytical chemistry, 2007 - ACS Publications
A novel method for performing electrophoretic separations is described gradient elution moving
boundary electrophoresis (GEMBE). The technique utilizes the electrophoretic migration …