Difference between revisions of "Rizzo Lab Information and Tutorials"
From Rizzo_Lab
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*[http://blaster.docking.org/zinc/ ZINC (ligand database)] | *[http://blaster.docking.org/zinc/ ZINC (ligand database)] | ||
*[[Families in the Protein Databank]] | *[[Families in the Protein Databank]] | ||
| − | *[[Automated | + | *[[Automated Family generation from PDB]] |
*[[Drug-like organic molecules]] | *[[Drug-like organic molecules]] | ||
Revision as of 11:22, 4 February 2019
Contents
Visualization Software
Basic Linux Tools
Docking
De novo Design using DOCK
Molecular Dynamics
GROMACS
Monte Carlo
Analysis Tools
Databases
- PubChem (ligand database)
- NIST (small molecule database)
- ZINC (ligand database)
- Families in the Protein Databank
- Automated Family generation from PDB
- Drug-like organic molecules
