Web- and Cloud-based Software Infrastructure for Materials Design. - János Sallai; Gergely Varga; Sara Toth; Christopher R. Iacovella; Christoph Klein 003; Clare McCabe; Ákos Lédeczi; Peter T. Cummings (ICCS, 2014)

A Hierarchical, Component Based Approach to Screening Properties of Soft Matter. - Christoph Klein 003; János Sallai; Trevor J. Jones; Christopher R. Iacovella; Clare McCabe; Peter T. Cummings (FOMMS, 2015)

Development of a Coarse-Grained Water Forcefield via Multistate Iterative Boltzmann Inversion. - Timothy C. Moore; Christopher R. Iacovella; Clare McCabe (FOMMS, 2015)

MoSDeF-GOMC: Python Software for the Creation of Scientific Workflows for the Monte Carlo Simulation Engine GOMC. - Brad Crawford; Umesh Timalsina; Co D. Quach; Nicholas C. Craven; Justin B. Gilmer; Clare McCabe; Peter T. Cummings; Jeffrey J. Potoff (J. Chem. Inf. Model., 2023)

MoSDeF-dihedral-fit: A lightweight software for fitting dihedrals within MoSDeF. - Brad Crawford; Co D. Quach; Nicholas C. Craven; Christopher R. Iacovella; Clare McCabe; Peter T. Cummings; Jeffrey J. Potoff (J. Open Source Softw., 2024)