TY - CHAP U1 - Konferenzveröffentlichung A1 - Hülsmann, Marco A1 - Kirschner, Karl N. A1 - Krämer, Andreas A1 - Heinrich, Doron D. A1 - Krämer-Fuhrmann, Ottmar A1 - Reith, Dirk T1 - Optimizing Molecular Models Through Force-Field Parameterization via the Efficient Combination of Modular Program Packages T2 - Snurr, Adjiman et al. (Eds.): Foundations of molecular modeling and simulation. Select papers from FOMMS 2015 KW - Numerical optimization KW - High-performance computing KW - Molecular modeling KW - Force field KW - Modular software packages SN - 978-981-10-1126-9 SB - 978-981-10-1126-9 U6 - https://doi.org/10.1007/978-981-10-1128-3_4 DO - https://doi.org/10.1007/978-981-10-1128-3_4 N1 - 2015 Foundations of Molecular Modeling and Simulation (FOMMS) conference, July 12–16, 2015, Mount Hood, Oregon SP - 53 EP - 77 PB - Springer CY - Singapore ER -