Repository revision
4:f4230f116196

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

Generate MD topologies for small molecules tool metadata
Miscellaneous
using acpype
ambertools_acpype
toolshed.g2.bx.psu.edu/repos/chemteam/ambertools_acpype/ambertools_acpype/19.11
19.11
None
True
Version lineage of this tool (guids ordered most recent to oldest)
toolshed.g2.bx.psu.edu/repos/chemteam/ambertools_acpype/ambertools_acpype/20.15+galaxy0
toolshed.g2.bx.psu.edu/repos/chemteam/ambertools_acpype/ambertools_acpype/19.11 (this tool)
toolshed.g2.bx.psu.edu/repos/chemteam/ambertools_acpype/ambertools_acpype/19.0.1
toolshed.g2.bx.psu.edu/repos/chemteam/ambertools_acpype/ambertools_acpype/19.0
ambertools_acpype
Requirements (dependencies defined in the <requirements> tag set)
name version type
ambertools 19.11 package
acpype 2019.10.05.12.26 package
Functional tests
name inputs outputs required files
Test-1 input1: JZ4.mol2
save_gro: True
attributes: name
attributes: name
JZ4.mol2
name