Universität Wien

812235 VO Analyse von Struktur-Wirkungs-Beziehungen (2004S)

Analyse von Struktur-Wirkungs-Beziehungen

0.00 ECTS (1.00 SWS), UG99 Pharm-Chemie

Details

Language: German

Lecturers

Classes (iCal) - next class is marked with N

  • Monday 01.03. 17:00 - 18:30 UZA2 Hörsaal 4 (Raum 2Z221) 2.OG
  • Monday 08.03. 17:00 - 18:30 UZA2 Hörsaal 4 (Raum 2Z221) 2.OG
  • Monday 15.03. 17:00 - 18:30 UZA2 Hörsaal 4 (Raum 2Z221) 2.OG
  • Monday 22.03. 17:00 - 18:30 UZA2 Hörsaal 4 (Raum 2Z221) 2.OG
  • Monday 29.03. 17:00 - 18:30 UZA2 Hörsaal 4 (Raum 2Z221) 2.OG
  • Monday 05.04. 17:00 - 18:30 UZA2 Hörsaal 4 (Raum 2Z221) 2.OG
  • Monday 19.04. 17:00 - 18:30 UZA2 Hörsaal 4 (Raum 2Z221) 2.OG
  • Monday 26.04. 17:00 - 18:30 UZA2 Hörsaal 4 (Raum 2Z221) 2.OG

Information

Aims, contents and method of the course

ECTS: 1.1
Content: historical overview; identification of lead compounds (serendipity, natural products, metabolism, side effects, transition state mimicry, high throughput screening); interaction forces involved in drug-biomolecule interaction (electrostatic, steric, hydrophobic, hydrogen bonding); descriptors (logP, sigma Hammett, Verloop, Taft parameters, autocorrelation vectors, indicator variables); receptor theories, determination of biological activity; methods for correlation analysis (Hansch-analysis, Free-Wilson, Topliss approach); statistical validation of models (external test set, cross validation, random shuffling); 3D-QSAR methods (CoMFA, CoMSIA); structure based drug design; de novo design (LUDI);
Prerequisites: 1st part completed
Exam: oral

Assessment and permitted materials

Minimum requirements and assessment criteria

Examination topics

Reading list

Association in the course directory

N2270

Last modified: Sa 02.04.2022 00:31