Searched defs:traj1 (Results 1 – 3 of 3) sorted by relevance
| /dports/science/gromacs/gromacs-2021.4/tests/physicalvalidation/physical_validation/util/ |
| H A D | ensemble.py | 45 def generate_histograms(traj1, traj2, g1, g2, bins): argument
58 def do_linear_fit(traj1, traj2, g1, g2, bins, argument
132 def do_max_likelihood_fit(traj1, traj2, g1, g2, argument
303 def check_bins(traj1, traj2, bins): argument
474 def check_1d(traj1, traj2, param1, param2, kb, argument
721 def check_2d(traj1, traj2, param1, param2, kb, pvconvert, argument
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| H A D | trajectory.py | 204 def overlap(traj1, traj2, cut=None, verbose=False, name=None): argument
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| /dports/science/py-ase/ase-3.22.0/ase/test/fio/ |
| H A D | test_vasp_structure.py | 32 def assert_trajectory_almost_equal(self, traj1, traj2): argument
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