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Fix a bug related to the python bindings of the analysis backend
Also add a test to catch these problems early
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[-11.78911323 43.40048831 1.57645506] | ||
[-14.14325234 40.56472505 2.0471197 ] | ||
[-18.32734558 37.03027119 2.42922245] | ||
[-23.77341355 35.3688551 1.82196622] | ||
[-30.6031531 34.80713034 4.54497927] | ||
[-34.02963687 36.94788357 9.20757146] | ||
[-38.71207711 36.98956237 6.66388904] | ||
[-37.41612362 38.95930485 5.18552101] | ||
[-35.66393047 38.5800238 2.98663143] | ||
[-38.16168017 34.77034427 5.37125748] |
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backend = CPU | ||
|
||
steps = 1e6 | ||
newtonian_steps = 103 | ||
diff_coeff = 2.50 | ||
#pt = 0.1 | ||
thermostat = john | ||
|
||
T = 20C | ||
dt = 0.005 | ||
verlet_skin = 0.05 | ||
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||
topology = dsdna8.top | ||
conf_file = non_existing_conf.dat | ||
trajectory_file = trajectory_analysis.dat | ||
refresh_vel = true | ||
log_file = log.dat | ||
no_stdout_energy = true | ||
restart_step_counter = true | ||
energy_file = energy.dat | ||
print_conf_interval = 1e5 | ||
print_energy_every = 1e3 | ||
time_scale = linear | ||
external_forces = false |
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DiffFiles::last_nucleotide_correct.dat::last_nucleotide.dat | ||
DiffFiles::first_nucleotide_correct.dat::first_nucleotide.dat |
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