2003

Originalarbeiten

M. Höltje und H.-D. Höltje
Applications of Quantum Chemical Methods in Drug Design
Medicinal Quantum Chemistry, Carloni and Alber, EDS, Wiley-VCH, (2003)


S. Hammer, I. Spika, W. Sippl, G. Jessen, B. Kleuser, H.-D. Höltje und M. Schäfer-Korting
Glucocorticoid Receptor Interactions with Glucocorticoids: Evaluation by Molecular Modeling and Functional Analysis of Glucocorticoid Receptor Mutants
Steroids, Vol.68: 329-339 (2003)

M. Langer, M. Höltje, N.A. Urbanetz, B. Brandt, H.-D. Höltje, B.C. Lippold
Investigations on the predictabilityof the information of glassy solid solutions of drugs in sugar alcohols
Int. J. Pharm. 252 : 167-179 (2003)

J. Hermann, L. Ridder, A. Mulholland, H.-D. Höltje
Identification of Glu166 as the General Base in the Acylation Reaction of Class A ß-Lactamases through QM/MM Modeling
J. Am. Chem. Soc. 125(32), 9590 (2003)

U. Voigtländer, A. Raasch, C. Tränkle, S. Buller, J. Ellis, K. Mohr, K. Jöhren , H.-D. Höltje
Allosteric site on muscarinic acetylcholine receptors: Identification of two amino acids selectives of some structurally diverse allosteric ligands
Mol. Pharmacol. 64, 21-31 (2003)

C. Anézo, A.H. de Vries, H.-D. Höltje, D. P. Tieleman, S.-J. Marrink
Methodological issues in lipid bilayer simulations
Journal of Physical Chemistry, 107, 9424-9433 (2003)

H.-D. Höltje, W. Sippl, D. Rognan, G.Folkers
Molecular Modeling
Basic Principles and Applications. 2nd Edition
Wiley-VCH, Heidelberg 2003

A. Hackling, R. Ghosh, S. Perachon, A. Mann, H.-D. Höltje, C.G. Wermuth,J.-C. Schwartz, W. Sippl, P. Solokoff, H. Stark
N-(w-(4-(2-Methoxyphenyl)piperazin-1-yl)alkyl)carboxamides as Dopamine D2 und D3 Receptor Ligands
J. Med. Chem. 46, 38883-3899 (2003)

H.-D. Höltje
Pharmacophore Identification and Receptor Mapping
in: The Practice of Medicinal Chemistry; C. Wermuth, Editor
Elsevier Science Publ., Amsterdam 2003

B. Bröer, M. Gurrath und H.-D. Höltje
Molecular Modelling Studies on the ORL1-Receptor and ORL1-Agonists
Journal of Computer Aided Molecular Design 17, 739-754 (2003)

Abstracts

J. Hermann, L. Ridder, A. Mulholland, H.-D. Höltje
Investigations on the Acylation of Tem1 ß-Lactamase from E.Coli
"Computational Modelling of Catalysis, Symposium at the Max-Planck-Institut für Kohlenforschung"
Mühlheim a.d.Ruhr 2003

A. Vollbrecht, K.-J. Schleifer, H.-D. Höltje
Homology Model of L-Type Calcium Channels - Investigations on the Selectivity Filter and the Dihydropyridine Binding Site
"17. Darmstädter Molecular-Modelling-Workshop"
27.05.-28.05.03, Erlangen

D. Classen-Houben, W. Sippl, H.-D. Höltje
Development of Ligand based and receptor based 3D-QSAR Models of Protein-Tyrosin-Phosphatase 1B Inhibitors
"17. Darmstädter Molecular-Modelling-Workshop"
27.05.-28.05.03, Erlangen

D. Classen-Houben, W. Sippl, H.-D. Höltje
Entwicklung von ligand- und rezeptorbasierten 3D-QSAR Modellen für Protein-Tyrosin-Phosphatase 1B Inhibitoren
"Doktorandentagung der DPhG"
07.03.-08.03.03, Düsseldorf