Publication - Journal Article ISiCLE: A Quantum Chemistry Pipeline for Establishing in Silico Collision Cross Section Libraries

Analytical Chemistry, vol. 91, iss. 7, pp. 4346-4356, 2019

Sean M. Colby, Dennis G. Thomas, Jamie R. Nuñez, Douglas J. Baxter, Kurt R. Glaesemann, Joseph M. Brown, Meg A. Pirrung, Niranjan Govind, Justin G. Teeguarden, Thomas O. Metz, Ryan S. Renslow