Universität Wien

270016 VO Computer Graphics and Molecular Modelling (2008W)

2.50 ECTS (2.00 SWS), SPL 27 - Chemie

Vorbesprechung und Terminvereinbarung: Do, 2.Oktober, 16.30 Uhr
Seminarraum (Erdgeschoß)
Institut für Computergestützte Biologische Chemie, Währingerstr.17, 1090 Wien

Details

Language: German

Lecturers

Classes

Currently no class schedule is known.

Information

Aims, contents and method of the course

Contents:
1. Geometry: RMSD, radius of gyration, SASA, B-factors
2. Enegetics: Knowledge-based potentials, force field, minimization, normal mode analysis
3. Statistics: Monte Carlo method
4. Solvation: Continuum models and generalized Born

Assessment and permitted materials

Minimum requirements and assessment criteria

Presentation of the theoretical concepts used in the accompaning exercises.

Examination topics

Grading: Oral exam.

Reading list

Association in the course directory

TC-3, M205, M206

Last modified: Fr 31.08.2018 08:55