Mercurial > repos > chemteam > mdanalysis_dihedral
annotate macros.xml @ 2:2fff8653412f draft
planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/ commit 8e1fece3eaef36823e90f5d10f8bb8b809544c55
author | chemteam |
---|---|
date | Sun, 13 Jan 2019 03:23:55 -0500 |
parents | f95d4348ed7c |
children | 554f60da9c8f |
rev | line source |
---|---|
0
f95d4348ed7c
planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/ commit c32fe331f438df7760084b27bafad9f78f01edde
chemteam
parents:
diff
changeset
|
1 <macros> |
f95d4348ed7c
planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/ commit c32fe331f438df7760084b27bafad9f78f01edde
chemteam
parents:
diff
changeset
|
2 <token name="@VERSION@">0.18</token> |
f95d4348ed7c
planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/ commit c32fe331f438df7760084b27bafad9f78f01edde
chemteam
parents:
diff
changeset
|
3 <xml name="requirements"> |
f95d4348ed7c
planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/ commit c32fe331f438df7760084b27bafad9f78f01edde
chemteam
parents:
diff
changeset
|
4 <requirements> |
f95d4348ed7c
planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/ commit c32fe331f438df7760084b27bafad9f78f01edde
chemteam
parents:
diff
changeset
|
5 <requirement type="package" version="0.18.0">mdanalysis</requirement> |
f95d4348ed7c
planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/ commit c32fe331f438df7760084b27bafad9f78f01edde
chemteam
parents:
diff
changeset
|
6 </requirements> |
f95d4348ed7c
planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/ commit c32fe331f438df7760084b27bafad9f78f01edde
chemteam
parents:
diff
changeset
|
7 </xml> |
f95d4348ed7c
planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/ commit c32fe331f438df7760084b27bafad9f78f01edde
chemteam
parents:
diff
changeset
|
8 <xml name="analysis_inputs"> |
f95d4348ed7c
planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/ commit c32fe331f438df7760084b27bafad9f78f01edde
chemteam
parents:
diff
changeset
|
9 <param format="dcd" name="dcdin" type="data" label="dcd trajectory input"/> |
f95d4348ed7c
planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/ commit c32fe331f438df7760084b27bafad9f78f01edde
chemteam
parents:
diff
changeset
|
10 <param format="pdb" name="pdbin" type="data" label="pdb input"/> |
f95d4348ed7c
planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/ commit c32fe331f438df7760084b27bafad9f78f01edde
chemteam
parents:
diff
changeset
|
11 <yield/> |
f95d4348ed7c
planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/ commit c32fe331f438df7760084b27bafad9f78f01edde
chemteam
parents:
diff
changeset
|
12 </xml> |
f95d4348ed7c
planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/ commit c32fe331f438df7760084b27bafad9f78f01edde
chemteam
parents:
diff
changeset
|
13 <xml name="tests_inputs"> |
f95d4348ed7c
planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/ commit c32fe331f438df7760084b27bafad9f78f01edde
chemteam
parents:
diff
changeset
|
14 <param name="dcdin" value="test.dcd" /> |
f95d4348ed7c
planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/ commit c32fe331f438df7760084b27bafad9f78f01edde
chemteam
parents:
diff
changeset
|
15 <param name="pdbin" value="test.pdb" /> |
f95d4348ed7c
planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/ commit c32fe331f438df7760084b27bafad9f78f01edde
chemteam
parents:
diff
changeset
|
16 <yield/> |
f95d4348ed7c
planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/ commit c32fe331f438df7760084b27bafad9f78f01edde
chemteam
parents:
diff
changeset
|
17 </xml> |
f95d4348ed7c
planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/ commit c32fe331f438df7760084b27bafad9f78f01edde
chemteam
parents:
diff
changeset
|
18 <xml name="citations"> |
f95d4348ed7c
planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/ commit c32fe331f438df7760084b27bafad9f78f01edde
chemteam
parents:
diff
changeset
|
19 <citations> |
f95d4348ed7c
planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/ commit c32fe331f438df7760084b27bafad9f78f01edde
chemteam
parents:
diff
changeset
|
20 <citation type="doi">10.1002/jcc.21787</citation> |
f95d4348ed7c
planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/ commit c32fe331f438df7760084b27bafad9f78f01edde
chemteam
parents:
diff
changeset
|
21 </citations> |
f95d4348ed7c
planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/ commit c32fe331f438df7760084b27bafad9f78f01edde
chemteam
parents:
diff
changeset
|
22 </xml> |
f95d4348ed7c
planemo upload for repository https://github.com/galaxycomputationalchemistry/galaxy-tools-compchem/ commit c32fe331f438df7760084b27bafad9f78f01edde
chemteam
parents:
diff
changeset
|
23 </macros> |