Hadjidoukas, P. E.; Angelikopoulos, P.; Papadimitriou, C.; Koumoutsakos, P. \(\Pi\)4U: a high performance computing framework for Bayesian uncertainty quantification of complex models. (English) Zbl 1352.65009 J. Comput. Phys. 284, 1-21 (2015). MSC: 65C05 62F15 65Y10 65Y15 82C80 76T25 74S30 76M25 × Cite Format Result Cite Review PDF Full Text: DOI
Krämer, Andreas; Hülsmann, Marco; Köddermann, Thorsten; Reith, Dirk Automated parameterization of intermolecular pair potentials using global optimization techniques. (English) Zbl 1360.65174 Comput. Phys. Commun. 185, No. 12, 3228-3239 (2014). MSC: 65K10 65C05 82-08 × Cite Format Result Cite Review PDF Full Text: DOI Link