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New dataflow model for rapid processing of large volumes of LC/UV/MS data
EP34434
Poster Title: New dataflow model for rapid processing of large volumes of LC/UV/MS data
Submitted on 05 Nov 2020
Author(s): Richard Lee1 Andrey Paramonov 1 , Eugene Vodopianov 1 , Vladislav Solomatin 1
Affiliations: Advanced Chemistry Development, Inc. (ACD/Labs), 8 King Street East, Toronto, ON. M5C 1B5. Canada
Poster Views: 359
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Poster Information
Abstract: Experimental challenges
20-80% of LC data must be reanalyzed because:
1. Open access methods are too generic & give sub par results
2. Retention time shifts over the ~5 hours needed to run a 96 well plate & over column lifetime
3. Column overloading when samples are injected directly from reaction plate
4. Targeted vs. untargeted processing 5. Unexpected by products

Technology challenges
1. Many instrument vendors & data formats
2. Databases that are slow at retrieving hyphenated data
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