Zentralinstitut für Scientific Computing (ZISC)

On the Resource Requirements of the Hyper-Scale waLBerla Project (2007) Donath S, Götz J, Feichtinger C, Iglberger K, Bergler S, Rüde U Other publication type 2,4-diamino-9H-pyrimido[4,5-b]indol-5-ols: Synthesis, in vitro cytotoxic activity, and QSAR investigations (2006) Dotzauer B, Grunert R, Bednarski PJ, Lanig H, Landwehr J, Troschütz R Journal article, Original article AMBER force-field parameters for phosphorylated amino acids in different protonation states: phosphoserine, phosphothreonine, phosphotyrosine, and phosphohistidine. (2006) Homeyer N, Horn A, Lanig H, Sticht H Journal article, Original article Optimization of Cache Oblivious Lattice Boltzmann Method in 2D and 3D (2006) Iglberger K, Rüde U, Feichtinger C, Wellein G, Hager G, Nitsure A Conference contribution Free Surface Flows with Moving and Deforming Objects for LBM (2006) Thürey N, Iglberger K, Rüde U Conference contribution Simulation of Moving Nano-Particles with the Lattice Boltzmann Method in 3D (2005) Iglberger K, Thürey N, Rüde U, Peukert W, Schmid HJ Conference contribution Structural variations of piritrexim, a lipophilic inhibitor of human dihydrofolate reductase: synthesis, antitumor activity and molecular modeling investigations. (2004) Zink M, Lanig H, Troschütz R Journal article, Original article Three-dimensional modeling of a pre-B-cell receptor. (2004) Lanig H, Bradl H, Jäck HM Journal article, Original article How does Mg2+ affect the binding of anhydrotetracycline in the TetR protein? (2004) Leypold C, Marian DT, Roman C, Schneider S, Schubert P, Scholz O, Hillen W, et al. Journal article Molecular Dynamics (2003) Lanig H Book chapter / Article in edited volumes