Repository revision
20:bc31d02be922

Repository 'gmx_merge_topology_files'
hg clone https://toolshed.g2.bx.psu.edu/repos/chemteam/gmx_merge_topology_files

Merge GROMACS topologies tool metadata
Miscellaneous
and GRO files
gmx_merge_topology_files
toolshed.g2.bx.psu.edu/repos/chemteam/gmx_merge_topology_files/gmx_merge_topology_files/3.4.3+galaxy0
3.4.3+galaxy0
None
True
Version lineage of this tool (guids ordered most recent to oldest)
toolshed.g2.bx.psu.edu/repos/chemteam/gmx_merge_topology_files/gmx_merge_topology_files/3.4.3+galaxy0 (this tool)
toolshed.g2.bx.psu.edu/repos/chemteam/gmx_merge_topology_files/gmx_merge_topology_files/3.2.0+galaxy0
toolshed.g2.bx.psu.edu/repos/chemteam/gmx_merge_topology_files/gmx_merge_topology_files/3.2.0
toolshed.g2.bx.psu.edu/repos/chemteam/gmx_merge_topology_files/gmx_merge_topology_files/2019.1.4
toolshed.g2.bx.psu.edu/repos/chemteam/gmx_merge_topology_files/gmx_merge_topology_files/2019.1.3
toolshed.g2.bx.psu.edu/repos/chemteam/gmx_merge_topology_files/gmx_merge_topology_files/2019.1.2
toolshed.g2.bx.psu.edu/repos/chemteam/gmx_merge_topology_files/gmx_merge_topology_files/2019.1.1
toolshed.g2.bx.psu.edu/repos/chemteam/gmx_merge_topology_files/gmx_merge_topology_files/0.1.0
gmx_merge_topology_files
Requirements (dependencies defined in the <requirements> tag set)
name version type
parmed 3.4.3 package
Additional information about this tool
python '$__tool_directory__/merge_top.py' 
            --lig-top $lig_top
            --prot-top $prot_top
            --lig-gro $lig_gro
            --prot-gro $prot_gro
            --complex-top complex.top
            --complex-gro complex.gro
    
None
False
Functional tests
name inputs outputs required files
Test-1 prot_top: topol.top
lig_top: lig.itp
prot_gro: newbox.gro
lig_gro: lig.gro
name: value
name: value
topol.top
lig.itp
newbox.gro
lig.gro
value