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 Please cite our workflow if its results have been used in a publication:

• Das, S. Tanemura, K. A.; Dinpazhoh, L.; Keng, M.; Schumm, C.; Leay, L.; Asef, C. K.; Rainey, M.; Edison, A. S.; Fernandez, F. M.;  Merz Jr., K. M. “In silico Collision Cross Section (CCS) Calculations to Aid Metabolomic Annotation”. Manuscript submitted.