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20152020
most citedISiCLE: A molecular collision cross section calculation pipeline for establishing large in silico reference libraries for compound identification

5 citations · 9 across the 5 of their papers we have counts for

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physics.chem-ph2020

Exploring the impacts of conformer selection methods on ion mobility collision cross section predictions

Felicity F. Nielson, Sean M. Colby, Dennis G. Thomas +2

The prediction of structure dependent molecular properties, such as collision cross sections as measured using ion mobility spectrometry, are crucially dependent on the selection o…