PD Dr. Harald Lanig

Erlangen National High Performance Computing Center (NHR@FAU)

The mode of action of phospholipase A(2): Semiempirical MO calculations including the protein environment (2000) Schürer G, Lanig H, Clark T, Lanig H Journal article Molecular dynamics of a Schiff base tetramacrocycle studied by NMR and MD simulations. (2000) Grohmann A, Lanig H, Bauer W, Schmidt S, Heinemann FW Journal article, Original article 3D-QSAR OF D4-antagonists based on full conformational searches and quantum mechanically derived descriptors (1999) Hennemann M, Clark T, Lanig H Journal article A semiempirical QM/MM implementation and its application to the absorption of organic molecules in zeolites (1999) Clark T, Alex A, Beck B, Gedeck P, Lanig H Journal article Conformational Analysis of Tetracycline using Molecular Mechanical and Semiempirical MO-Calculations (1999) Lanig H, Clark T, Gottschalk M, Schneider S Journal article QM/MM calculations on the dimerization of vancomycin (1998) Lanig H, Clark T Journal article The catalytic mechanism of phospholipase A2: Semiempirical calculations including the protein environment by a QM/MM approach (1998) Schürer G, Lanig H, Clark T Journal article QM (semiempirical MO) MM binding studies. (1997) Clark T, Gedeck P, Lanig H, Beck B Other publication type Time-resolved fluorescence spectroscopy of helically distorted aromatic systems. (1997) Lanig H, Hof M, Bringmann G, Schneider F Journal article, Original article Solvent relaxation behaviour of n-anthroyloxy fatty acids in PC-vesicles and paraffin oil: a time-resolved emission spectra study. (1997) Lanig H, Hutterer R, Schneider FW, Hof M Journal article, Original article