Open-source molecular modeling software in chemical engineering focusing on the Molecular Simulation Design Framework
Published in AICHE JOURNAL, 2021
Recommended citation: Cummings, Peter T. McCabe, Clare Iacovella, Christopher R. Ledeczi, Akos Jankowski, Eric Jayaraman, Arthi Palmer, Jeremy C. Maginn, Edward J. Glotzer, Sharon C. Anderson, Joshua A. Ilja Siepmann, J. Potoff, Jeffrey Matsumoto, Ray A. Gilmer, Justin B. DeFever, Ryan S. Singh, Ramanish Crawford, Brad (2021). "Open-source molecular modeling software in chemical engineering focusing on the Molecular Simulation Design Framework ." AICHE JOURNAL. 67 (e17206).
Cummings, Peter T. McCabe, Clare Iacovella, Christopher R. Ledeczi, Akos Jankowski, Eric Jayaraman, Arthi Palmer, Jeremy C. Maginn, Edward J. Glotzer, Sharon C. Anderson, Joshua A. Ilja Siepmann, J. Potoff, Jeffrey Matsumoto, Ray A. Gilmer, Justin B. DeFever, Ryan S. Singh, Ramanish Crawford, Brad (2021). “Open-source molecular modeling software in chemical engineering focusing on the Molecular Simulation Design Framework .” AICHE JOURNAL. 67 (e17206), pp .
DOI: 10.1002/aic.17206
Funding source: National Science Foundation [OAC-1835874, OAC-1835612, OAC-1835630, OAC-1835067, OAC-1835613, OAC-1835593, OAC-1835713, OAC-1835560]