| Miscellaneous |
| Version lineage of this tool (guids ordered most recent to oldest) |
| toolshed.g2.bx.psu.edu/repos/chemteam/ambertools_antechamber/ambertools_antechamber/19.0.1 |
| toolshed.g2.bx.psu.edu/repos/chemteam/ambertools_antechamber/ambertools_antechamber/19.0 (this tool) |
| ambertools_antechamber |
| Requirements (dependencies defined in the <requirements> tag set) |
| name | version | type |
| ambertools | 19.0 | package |
| Functional tests |
| name | inputs | outputs | required files |
| Test-1 |
allparams|at: gaff2 input1: LigA.mol2 allparams|nc: -2 allparams|j: 5 allparams|c: bcc |
attributes: name |
LigA.mol2 name |
| Test-2 |
input1: LigA.pdb allparams|c: bcc selected_output_format: pdb allparams|nc: -2 allparams|j: 5 allparams|at: gaff2 |
attributes: name |
LigA.pdb name |