Bubles Code
Status: Beta
Brought to you by:
psfriso
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Tree [r10] / History
| File | Date | Author | Commit |
|---|---|---|---|
| docs | 2011-03-28 | psfriso | [r10] adding additional material |
| output_example | 2011-03-28 | psfriso | [r10] adding additional material |
| tests | 2011-03-27 | psfriso | [r6] add pdbs |
| visualize | 2011-03-28 | psfriso | [r8] add visualizing tool |
| BubFunctions.py | 2011-03-27 | psfriso | [r1] project |
| Bubbles.py | 2011-03-28 | psfriso | [r7] new version |
| Grid.py | 2011-03-27 | psfriso | [r1] project |
| README | 2011-03-28 | psfriso | [r10] adding additional material |
Read Me
########################################################
#### BUBBLES ####
########################################################
This is BUBBLES readme file.
DEPENDENCIES
To run BUBBLES you need to have numpy installed.
COMMAND LINE STRUCTURE
python Bubbles.py <MIP grid file> (<number gaussians as output>)
MIP file is mandatory
number of gaussians as output is set to 10 as default. Uses of a large
number here will give meaningless results.( 0.5-1 % of the grid size is OK)
OUTPUT
Output will be given at bubbles_out.dat
