Log in
Register
Give us Feedback
InviteWorkflow Entry: Automatic Protein-Ligand Docking
| Citations (0) | Version History | Reviews (0) | Comments (0) |
 Version 1
(of 1)
|
Version created on:
15/05/09 @ 03:36:40
by:
Jeffersontan
|
Revision comments 
Last edited on: 16/05/09 @ 04:36:19 by: Jeffersontan
Title: Automatic Protein-Ligand Docking
Type: Nimrod Parameter Sweep
Preview
(Click on the image to get the full size)
Description
Nimrod harnesses grid-based high-performance computing resources to evaluate a n umber of protein-ligand interaction algorithms. Different computational chemistry
approaches are combined with non-linear optimization algorithms. This work is explained in Abramson, D. A., Amoreira, C., Baldridge, K. K., Berstis, L., Kondrick, C., Peachey, T. C., 2006, "A flexible grid framework for automatic protein-ligand docking", Proceedings of the Second IEEE International Conference on e-Science and Grid Computing, 04 December 2006 to 06 December 2006, IEEE Computer Society, Los Alamitos USA, pp. 1-8. Available online here.
More information about:
- Nimrod-enabled e-Science applications
- Nimrod
- the Nimrod/ARCS portal, available upon request (and subject to registration)
Download
Run
Not available
Workflow Components
Not available
Workflow Type
Log in to add Tags
Shared with Groups (0)
None
Current:
0.0 / 5
(0 ratings)
Log in to rate and see breakdown of ratings
Statistics
None
Earliest Version:
[1] - Automatic Protein-Ligand Docking
This Workflow only has one version.
Reviews
(0)
Other workflows that use similar services
(0)
There are no workflows in myExperiment that use similar services to this Workflow.
Linked Data
Non-Information Resource URI: http://www.myexperiment.org/workflows/758
Alternative Formats
Copyright © 2007 - 2011 The University of Manchester and University of Southampton
No comments yet
Log in to make a comment