27 September 2022
Europe/Lisbon timezone

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

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