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POST
Submit Job

Authorizations

x-api-key
string
header
required

Body

application/json
box_id
string

Associated system/box id

Minimum string length: 1
batch_index
integer | null

Index of this job in the batch

Required range: x >= 0
batch_name
string | null

Human-friendly batch name

equilibration
EquilibrationStep · object[] | null

Equilibration stages to run before production

production
ProductionParams · object | null

Production simulation parameters

temperature
number | null

Temperature (K)

Required range: x >= 0
pressure
number | null

Pressure (bar)

Required range: x >= 0
surface_tension
number | null

Surface tension (bar·nm)

Required range: x >= 0
friction
number | null

Friction coefficient (ps⁻¹)

Required range: x >= 0
integration_timestep
number | null

Time step (fs)

Required range: x > 0
ewald_error_tolerance
number | null

PME/Ewald error tolerance

Required range: x > 0
non_bonded_cutoff
number | null

Non-bonded cutoff (nm)

Required range: x > 0
minimization_steps
integer | null

Energy minimization steps

Required range: x >= 0
trajectory_output_format
enum<string> | null

e.g., 'dcd'

Available options:
dcd

Response

Successful Response