Coverage for /builds/ase/ase/ase/optimize/__init__.py: 100.00%

1# fmt: off 

2 

3"""Structure optimization. """ 

4 

5from ase.optimize.bfgs import BFGS 

6from ase.optimize.bfgslinesearch import BFGSLineSearch 

7from ase.optimize.cellawarebfgs import CellAwareBFGS 

8from ase.optimize.fire import FIRE 

9from ase.optimize.fire2 import FIRE2 

10from ase.optimize.gpmin.gpmin import GPMin 

11from ase.optimize.lbfgs import LBFGS, LBFGSLineSearch 

12from ase.optimize.mdmin import MDMin 

13from ase.optimize.ode import ODE12r 

14from ase.optimize.oldqn import GoodOldQuasiNewton 

15from ase.optimize.optimize import RestartError 

16 

17QuasiNewton = BFGSLineSearch 

18 

19__all__ = ['MDMin', 'FIRE', 'FIRE2', 'LBFGS', 

20 'LBFGSLineSearch', 'BFGSLineSearch', 'BFGS', 

21 'GoodOldQuasiNewton', 'QuasiNewton', 'GPMin', 

22 'CellAwareBFGS', 'ODE12r', 'RestartError']