538813 Applications of Chemml Program Suite in Predicting Properties of Organic Materials: A Path to Data-Driven Discovery in Chemistry

Mojtaba Haghighatlari, Chemical and Biological Engineering, University at Buffalo, The State University of New York, Buffalo, NY and Johannes Hachmann, Computational and Data-Enabled Science and Engineering Graduate Program, University at Buffalo, SUNY, Buffalo, NY; Chemical and Biological Engineering, University at Buffalo, SUNY, Buffalo, NY; New York State Center of Excellence in Materials Informatics, University at Buffalo, Buffalo, NY