Repository revision
1:f0502d809c4b

Repository 'openbabel_structure_distance_finder'
hg clone https://toolshed.g2.bx.psu.edu/repos/bgruening/openbabel_structure_distance_finder

Determine distance to defined points tool metadata
Miscellaneous
- determine the minimum distances between a molecule and a set of 3D points
openbabel_structure_distance_finder
toolshed.g2.bx.psu.edu/repos/bgruening/openbabel_structure_distance_finder/openbabel_structure_distance_finder/0.1.0
0.1.0
None
True
Version lineage of this tool (guids ordered most recent to oldest)
toolshed.g2.bx.psu.edu/repos/bgruening/openbabel_structure_distance_finder/openbabel_structure_distance_finder/3.1.1+galaxy0
toolshed.g2.bx.psu.edu/repos/bgruening/openbabel_structure_distance_finder/openbabel_structure_distance_finder/0.1.0 (this tool)
openbabel_structure_distance_finder
Requirements (dependencies defined in the <requirements> tag set)
name version type
openbabel 3.0.0 package
Functional tests
name inputs outputs required files
Test-1 input: ligands.sdf
points: 5.655 1.497 18.223
attributes: name
ligands.sdf
name