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Title: IMS - MS Data Extractor

An automated drift time extraction and computed associated collision cross section software tool for small molecule analysis with ion mobility spectrometry-mass spectrometry (IMS-MS). The software automatically extracts drift times and computes associated collision cross sections for small molecules analyzed using ion mobility spectrometry-mass spectrometry (IMS-MS) based on a target list of expected ions provided by the user.
Publication Date:
OSTI Identifier:
1232492
Report Number(s):
IMS-MS DATA EXTRACT; 003797IBMPC00
R&D Project: LDRD; IPID 30818-E
DOE Contract Number:
AC05-76RL01830
Software Revision:
00
Software Package Number:
003797
Software Package Contents:
Open Source Software package available from Pacific Northwest National Laboratory at the following URL: https://github.com/PNNL-Comp-Mass-Spec/PIXIE
Software CPU:
IBMPC
Open Source:
Yes
Source Code Available:
Yes
Research Org:
PNNL
Sponsoring Org:
United States Department of Energy
Contributing Orgs:
Jian Ma, PNNL Tom Metz, PNNL Erin Baker, PNNL
Country of Publication:
United States

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