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Rename imports from ase.ga to ase_ga #2

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Rename imports from ase.ga to ase_ga #2

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24 changes: 12 additions & 12 deletions oganesson/genetic_algorithms/__init__.py
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Original file line number Diff line number Diff line change
@@ -1,22 +1,22 @@
from ase.io import write
from ase.ga import get_raw_score
from ase.ga.data import DataConnection
from ase.ga.population import Population
from ase.ga.utilities import closest_distances_generator, CellBounds
from ase.ga.ofp_comparator import OFPComparator
from ase.ga.offspring_creator import OperationSelector
from ase.ga.standardmutations import StrainMutation
from ase.ga.soft_mutation import SoftMutation
from ase.ga.cutandsplicepairing import CutAndSplicePairing
from ase_ga import get_raw_score
from ase_ga.data import DataConnection
from ase_ga.population import Population
from ase_ga.utilities import closest_distances_generator, CellBounds
from ase_ga.ofp_comparator import OFPComparator
from ase_ga.offspring_creator import OperationSelector
from ase_ga.standardmutations import StrainMutation
from ase_ga.soft_mutation import SoftMutation
from ase_ga.cutandsplicepairing import CutAndSplicePairing
from oganesson.genetic_algorithms.particle_mutations import (
Poor2richPermutation,
Rich2poorPermutation,
)
from ase import Atoms
from ase.data import atomic_numbers
from ase.ga.startgenerator import StartGenerator
from ase.ga.data import PrepareDB
from ase.ga import set_raw_score
from ase_ga.startgenerator import StartGenerator
from ase_ga.data import PrepareDB
from ase_ga import set_raw_score
from oganesson.ogstructure import OgStructure
import os
from typing import List
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6 changes: 3 additions & 3 deletions oganesson/genetic_algorithms/particle_mutations.py
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Original file line number Diff line number Diff line change
@@ -1,9 +1,9 @@
import numpy as np
from operator import itemgetter
from oganesson.ogstructure import OgStructure
from ase.ga.offspring_creator import OffspringCreator
from ase.ga.utilities import get_distance_matrix
from ase.ga.particle_mutations import Mutation
from ase_ga.offspring_creator import OffspringCreator
from ase_ga.utilities import get_distance_matrix
from ase_ga.particle_mutations import Mutation
from ase import Atoms

def get_nndist(atoms, distance_matrix, rmax):
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1 change: 1 addition & 0 deletions setup.py
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Original file line number Diff line number Diff line change
Expand Up @@ -26,6 +26,7 @@
keywords=["ai", "machine learning", 'material science'],
install_requires=[
"ase",
"ase_ga",
"pandas",
"numpy",
"pymatgen",
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