PD Dr. Harald Lanig

Erlangen National High Performance Computing Center (NHR@FAU)

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 Molecular dynamics simulation links conformation of a pore-flanking region to hyperekplexia-related dysfunction of the inhibitory glycine receptor (2004) Breitinger HGA, Lanig H, Breitinger U, Clark T Journal article Aeromonas proteolytica aminopeptidase: An investigation of the mode of action using a quantum mechanical/molecular mechanical approach (2004) Schürer G, Lanig H, Clark T Journal article Three-dimensional modeling of a pre-B-cell receptor. (2004) Lanig H, Bradl H, Jäck HM Journal article, Original article Quantum mechanical/molecular mechanical (QM/MM) docking: A new protocol and its evaluation for known test systems. (2004) Horn A, Beierlein F, Lanig H, Schürer G, Clark T Other publication type MD/CI-approach simulating FRET in proteins. (2004) Beierlein F, Lanig H, Othersen O, Schneider S, Clark T Other publication type 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 Systematic surface scan of the most favorable interaction sites of magnesium ions with tetracycline (2003) Othersen O, Lanig H, Clark T Journal article Conformations and tautomers of tetracycline (2003) Othersen O, Beierlein F, Lanig H, Clark T Journal article Quantum mechanical/molecular mechanical (QM/MM) docking: an evaluation for known test systems (2003) Beierlein F, Lanig H, Schürer G, Horn A, Clark T Journal article