Educators:
Dr. Christiane Ehrt

Date:
04.03.2024

Location:
Erlangen - 36th Molecular Modelling Workshop 2024 (https://mmws2024.mgms-ds.de/index.php)

Contents:
Introduction to Structure-Based Design on ProteinsPlus: Exploring Structures with Protoss, EDIA, SIENA and MicroMiner, Exploring Protein-Ligand Interactions with PoseEdit and GeoMine

Learning goals:
learning to perform protein structure analyses, protein ensemble generation, protein-ligand interaction analysis

Prerequisites:
basic knowledge on protein structures, binding sites, and their interactions with small molecules

Keywords:
structure-based drug design, protein structure analysis, protein-ligand interactions

Tools:
https://proteins.plus - ProteinsPlus web server tools (Structure Analysis: Protoss, EDIA, SIENA, MicroMiner; Protein-Ligand Interaction Analysis: PoseEdit, GeoMine)