pmx launch CV 19
Version 2 (latest)

Version 2 (latest)

Version 1 (earliest)

Workflow Type: Common Workflow Language

Work-in-progress

I don't even know. Only works on BSC.

Click and drag the diagram to pan, double click or use the controls to zoom.

SEEK ID: https://dev.workflowhub.eu/workflows/113?version=2

Inputs

ID	Name	Description	Type
step1_pdb_name	n/a	n/a	string
step1_pdb_config	n/a	n/a	string
step4_editconf_config	n/a	n/a	string
step6_gppion_config	n/a	n/a	string
step7_genion_config	n/a	n/a	string
step8_gppmin_config	n/a	n/a	string
step10_energy_min_config	n/a	n/a	string
step10_energy_min_name	n/a	n/a	string
step11_gppnvt_config	n/a	n/a	string
step13_energy_nvt_config	n/a	n/a	string
step13_energy_nvt_name	n/a	n/a	string
step14_gppnpt_config	n/a	n/a	string
step16_energy_npt_config	n/a	n/a	string
step16_energy_npt_name	n/a	n/a	string
step17_gppmd_config	n/a	n/a	string
step19_rmsfirst_config	n/a	n/a	string
step19_rmsfirst_name	n/a	n/a	string
step20_rmsexp_config	n/a	n/a	string
step20_rmsexp_name	n/a	n/a	string
step21_rgyr_config	n/a	n/a	string
step22_image_config	n/a	n/a	string
step23_dry_config	n/a	n/a	string

ID	Name	Description	Type
trr	n/a	n/a	File
trr_imaged_dry	n/a	n/a	File
gro_dry	n/a	n/a	File
gro	n/a	n/a	File
cpt	n/a	n/a	File
tpr	n/a	n/a	File
top	n/a	n/a	File
xvg_min	n/a	n/a	File
xvg_nvt	n/a	n/a	File
xvg_npt	n/a	n/a	File
xvg_rmsfirst	n/a	n/a	File
xvg_rmsexp	n/a	n/a	File
xvg_rgyr	n/a	n/a	File