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Recent blog posts
- Small Molecule Dihedrals Parametrization
- Gaussian 09 and Antechamber12
- Organic solvent boxes
- Parametrize new ligands for AMBER and CHARMM
- Gaussian09 bug fix
- Building AMBER 11 and AmberTools 1.5 on MacOS 10.6.8 (Snow Leopard): A command list
- Instructions to screen huge chemical collections with rDock
- Basic instructions to screen huge chemical collections with rDock
- Define contacts and binding site between a given ligand (x-ray or docking) and PDB file
- Hands-on tutorial & exercises of Gaussian
sruiz
Details
- First Name
- Sergi
- Last Name
- Ruiz Carmona
- Title
- 4 : Graduate Student
- Position
- PhD Student
- Project
History
- News by sruiz
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- Member for
- 1 year 47 weeks
- Blog
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