remove unused imports

This commit is contained in:
Axel Kohlmeyer
2022-06-14 10:45:05 -04:00
parent 6abb316dba
commit 2028c68bec
4 changed files with 3 additions and 6 deletions

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@ -1,7 +1,6 @@
#!/usr/bin/env python3 #!/usr/bin/env python3
# -*- coding: utf-8 -*- # -*- coding: utf-8 -*-
import sys
import numpy as np import numpy as np
def reduce_Born(Cf): def reduce_Born(Cf):

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@ -1,7 +1,6 @@
#!/usr/bin/env python3 #!/usr/bin/env python3
# -*- coding: utf-8 -*- # -*- coding: utf-8 -*-
import sys
import numpy as np import numpy as np
def reduce_Born(Cf): def reduce_Born(Cf):

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@ -26,7 +26,7 @@
# -nsteps 5 # -nsteps 5
# number of timesteps, default = 5 # number of timesteps, default = 5
import sys,math,random import sys
import mdi import mdi
import numpy as np import numpy as np
from mpi4py import MPI from mpi4py import MPI
@ -42,10 +42,9 @@ def error(txt=None):
def perform_aimd(world,mm_comm,qm_comm): def perform_aimd(world,mm_comm,qm_comm):
me = world.Get_rank() me = world.Get_rank()
nprocs = world.Get_size()
# receive number of atoms from the MM engine # receive number of atoms from the MM engine
mdi.MDI_Send_command("<NATOMS",mm_comm) mdi.MDI_Send_command("<NATOMS",mm_comm)
natoms = mdi.MDI_Recv(1,mdi.MDI_INT,mm_comm) natoms = mdi.MDI_Recv(1,mdi.MDI_INT,mm_comm)
natoms = world.bcast(natoms,root=0) natoms = world.bcast(natoms,root=0)

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@ -1,4 +1,4 @@
import hashlib,os,subprocess,sys import hashlib,os,subprocess
# try to auto-detect the maximum number of available CPUs # try to auto-detect the maximum number of available CPUs
def get_cpus(): def get_cpus():