Selected Publications
Journal Articles
Pantelides CC, Renfro JG, 2013, THE ONLINE USE OF FIRST-PRINCIPLES MODELS IN PROCESS OPERATIONS: REVIEW, CURRENT STATUS & FUTURE NEEDS
Kazantsev AV, Karamertzanis PG, Adjiman CS, et al. , 2011, Successful prediction of a model pharmaceutical in the fifth blind test of crystal structure prediction, International Journal of Pharmaceutics, Vol:418, ISSN:0378-5173, Pages:168-178
Kazantsev AV, Karamertzanis PG, Adjiman CS, et al. , 2011, Efficient Handling of Molecular Flexibility in Lattice Energy Minimization of Organic Crystals, Journal of Chemical Theory and Computation, Vol:7, ISSN:1549-9618, Pages:1998-2016