894005 Computer-aided drug design and discovery of bioactive natural products (in Eng.)
- Art
- Vorlesung und Übung
- Semesterstunden
- 2
- Vortragende/r (Mitwirkende/r)
- Istyastono, Enade
- Organisation
- Angeboten im Semester
- Wintersemester 2022/23
- Unterrichts-/ Lehrsprachen
- Englisch
- Lehrinhalt
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The course will include lectures/tutorials designed to provide an introduction into theoretical aspects underlying modern drug discovery and design techniques. These will be combined with hands-on computer sessions designed to provide an introduction into the practical aspects of performing and analyzing the computer experiments. The course will also provide a productive environment for discussion with experts and fellow participants.
- Inhaltliche Voraussetzungen (erwartete Kenntnisse)
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Basic knowledge about biomolecules is required
- Lehrziel
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Participants will gain knowledge about
1.Target selection and validation.
2.Natural products database compilation for structure-based virtual screening (SBVS).
3.Retrospective and prospective SBVS from the database.
4.Hits optimization by employing molecular dynamics simulations.
Noch mehr Informationen zur Lehrveranstaltung, wie Termine oder Informationen zu Prüfungen, usw.
finden Sie auf der Lehrveranstaltungsseite in BOKUonline.