Molecular Docking using PyRx Virtual Screening tool
Автор: Fun Molecules
Загружено: 2025-07-14
Просмотров: 507
Описание:
In this video, I’ll walk you through the complete process of molecular docking using PyRx – a powerful and free virtual screening tool widely used in drug discovery and bioinformatics research.
📌 What You’ll Learn:
How to prepare ligands and receptors for docking
How to import structures from PubChem / RCSB PDB
Step-by-step virtual screening workflow using AutoDock Vina within PyRx
Analyzing binding affinities and selecting the best ligand candidates
🛠️ Tools Used:
PyRx Virtual Screening Tool
AutoDock Vina
RCSB PDB databases
📽️ Whether you're designing inhibitors, exploring ligand-protein interactions, or just learning molecular docking for the first time—this tutorial will give you a solid start.
👍 Like the video, 💬 drop your questions below, and 🔔 Subscribe for more lab-tech and bioinformatics tutorials!
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