Publications around the MoSDeF Ecosystem

Klein, C., Sallai, J., Jones, T.J., Iacovella, C.R., McCabe, C., Cummings, P.T., 2016. A Hierarchical, Component Based Approach to Screening Properties of Soft Matter, in: Snurr, R.Q., Adjiman, C.S., Kofke, D.A. (Eds.), Foundations of Molecular Modeling and Simulation: Select Papers from FOMMS 2015, Molecular Modeling and Simulation. Springer Singapore, Singapore, pp. 79–92. https://doi.org/10.1007/978-981-10-1128-3_5

Klein, C., Summers, A.Z., Thompson, M.W., Gilmer, J.B., McCabe, C., Cummings, P.T., Sallai, J., Iacovella, C.R., 2019. Formalizing atom-typing and the dissemination of force fields with foyer. Computational Materials Science 167, 215–227. https://doi.org/10.1016/j.commatsci.2019.05.026

Thompson, M.W., Matsumoto, R., Sacci, R.L., Sanders, N.C., Cummings, P.T., 2019. Scalable Screening of Soft Matter: A Case Study of Mixtures of Ionic Liquids and Organic Solvents. J. Phys. Chem. B 123, 1340–1347. https://doi.org/10.1021/acs.jpcb.8b11527