Curso UCIBIO (Module 4 - Structure-based Virtual Screening)

Session

Módulo 4 - Structure-based Virtual Screening

27 Sept 2022, 14:00

Conveners

Módulo 4 - Structure-based Virtual Screening: Modelling

• Henrique Fernandes
• Sérgio Sousa
• Arménio Barbosa

Description

Software: Autodock e Vina, Datawarrior.

1. Brief Introduction to Structure-based drug discovery
2. Small Molecule Library Curation
3. Protein Preparation
4. Molecular Docking
5. Virtual Screening
6. Conclusion: Comparison of software performance in screening

Molecular System: Main Protease of SARS-CoV-2

Entrar na reunião Zoom
https://videoconf-colibri.zoom.us/j/97714659970?pwd=TGFoTVRwQlE1MldlUHJ2MHUxcHJBUT09

ID da reunião: 977 1465 9970
Senha de acesso: 651469

Presentation materials

Course_INCD_Module04.pdf

software list