forked from Eigenstate/dabble
Commit
This commit does not belong to any branch on this repository, and may belong to a fork outside of the repository.
Add pypi and conda packaging support
- Loading branch information
1 parent
fdc5a43
commit 324f026
Showing
5 changed files
with
37 additions
and
0 deletions.
There are no files selected for viewing
This file contains bidirectional Unicode text that may be interpreted or compiled differently than what appears below. To review, open the file in an editor that reveals hidden Unicode characters.
Learn more about bidirectional Unicode characters
Original file line number | Diff line number | Diff line change |
---|---|---|
@@ -0,0 +1,9 @@ | ||
include dabble.py | ||
include get_restraint_mask.py | ||
include molecule_to_psf.py | ||
|
||
recursive-include Dabble *.py | ||
recursive-include Dabble/lipid_membranes *.mae | ||
|
||
recursive-include DabbleParam *.py | ||
recursive-include DabbleParam/charmm_parameters *_all36_* |
This file contains bidirectional Unicode text that may be interpreted or compiled differently than what appears below. To review, open the file in an editor that reveals hidden Unicode characters.
Learn more about bidirectional Unicode characters
Original file line number | Diff line number | Diff line change |
---|---|---|
@@ -0,0 +1 @@ | ||
README.md |
This file contains bidirectional Unicode text that may be interpreted or compiled differently than what appears below. To review, open the file in an editor that reveals hidden Unicode characters.
Learn more about bidirectional Unicode characters
Original file line number | Diff line number | Diff line change |
---|---|---|
@@ -0,0 +1,2 @@ | ||
"%PYTHON%" setup.py install | ||
if errorlevel 1 exit 1 |
This file contains bidirectional Unicode text that may be interpreted or compiled differently than what appears below. To review, open the file in an editor that reveals hidden Unicode characters.
Learn more about bidirectional Unicode characters
Original file line number | Diff line number | Diff line change |
---|---|---|
@@ -0,0 +1,4 @@ | ||
#!/bin/bsh | ||
|
||
$PYTHON setup.py install | ||
|
This file contains bidirectional Unicode text that may be interpreted or compiled differently than what appears below. To review, open the file in an editor that reveals hidden Unicode characters.
Learn more about bidirectional Unicode characters
Original file line number | Diff line number | Diff line change |
---|---|---|
@@ -0,0 +1,21 @@ | ||
package: | ||
name: dabble | ||
version: "1.0.0a1" | ||
|
||
source: | ||
git_url: https://github.com/drorlab/dabble.git | ||
git_tag: master | ||
|
||
build: | ||
features: | ||
- builder | ||
- parameterizer | ||
- vmd | ||
|
||
script: python setup.py install | ||
|
||
requirements: | ||
run: | ||
- numpy | ||
- vmd | ||
|