Difference between revisions of "AutoDock"
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(Created page with "Category:SoftwareCategory:Biology {|<!--CONFIGURATION: REQUIRED--> |{{#vardefine:app|AutoDock}} |{{#vardefine:url|http://autodock.scripps.edu/}} <!--CONFIGURATION: OPT...") |
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==System Variables== | ==System Variables== | ||
| − | * HPC_{{ | + | * HPC_{{uc:{{#var:app}}}}_DIR - installation directory |
| − | * HPC_{{ | + | * HPC_{{uc:{{#var:app}}}}_BIN - executable directory |
<!--Configuration--> | <!--Configuration--> | ||
Revision as of 21:15, 6 December 2019
Description
AutoDock is a suite of automated docking tools. It is designed to predict how small molecules, such as substrates or drug candidates, bind to a receptor of known 3D structure.
Required Modules
Serial
- AutoDock
System Variables
- HPC_AUTODOCK_DIR - installation directory
- HPC_AUTODOCK_BIN - executable directory
Citation
If you publish research that uses AutoDock you have to cite it as follows: