PSI3: An open-source Ab Initio electronic structure package. - T. Daniel Crawford; C. David Sherrill; Edward F. Valeev; Justin T. Fermann; Rollin A. King; Matthew L. Leininger; Shawn T. Brown; Curtis L. Janssen; Edward T. Seidl; Joseph P. Kenny; Wesley D. Allen (J. Comput. Chem., 2007)

NSF's Inaugural Software Institutes: The Science Gateways Community Institute and the Molecular Sciences Software Institute. - Nancy Wilkins-Diehr; T. Daniel Crawford (Comput. Sci. Eng., 2018)

The MolSSI Driver Interface Project: A framework for standardized, on-the-fly interoperability between computational molecular sciences codes. - Taylor A. Barnes; Eliseo Marin-Rimoldi; Samuel Ellis; T. Daniel Crawford (Comput. Phys. Commun., 2021)

MolSSI Education: Empowering the Next Generation of Computational Molecular Scientists. - Jessica Nash; Mohammad Mostafanejad; T. Daniel Crawford; Ashley Ringer McDonald (Comput. Sci. Eng., 2022)