frag_pele/PlopRotTemp_S_2017/PlopRotTemp.py
def rvdw_change(rotamer_library, radius_vdw_info, start_index, end_index):
  """
    Change all radius vanderwals 0 to 0.5
    from the rotamer's library file
  """
  with open(rotamer_library, 'r') as f:
    lines = f.readlines()
    for i, new_line in enumerate(radius_vdw_info):
      lines[start_index + i] = '{0:>5} {1:>8} {2:>8} {3:>10} {4:>8} {5:>8} {6:>13} {7:>13}\n'.format(*new_line)

  with open(rotamer_library, 'w') as f:
    f.write(''.join(lines))

    Change all radius vanderwals 0 to 0.5
    from the rotamer's library file
  
Change all radius vanderwals 0 to 0.5
from the rotamer's library file
Change all radius vanderwals 0 to 0 . 5 from the rotamer ' s library file
def rvdw_change(rotamer_library, radius_vdw_info, start_index, end_index):
  with open(rotamer_library, 'r') as f:
    lines = f.readlines()
    for i, new_line in enumerate(radius_vdw_info):
      lines[start_index + i] = '{0:>5} {1:>8} {2:>8} {3:>10} {4:>8} {5:>8} {6:>13} {7:>13}\n'.format(*new_line)
  with open(rotamer_library, 'w') as f:
    f.write(''.join(lines))
def rvdw_change ( rotamer_library , radius_vdw_info , start_index , end_index ) : with open ( rotamer_library , 'r' ) as f : lines = f . readlines ( ) for i , new_line in enumerate ( radius_vdw_info ) : lines [ start_index + i ] = '{0:>5} {1:>8} {2:>8} {3:>10} {4:>8} {5:>8} {6:>13} {7:>13}\n' . format ( * new_line ) with open ( rotamer_library , 'w' ) as f : f . write ( '' . join ( lines ) )
Change all radius vanderwals 0 to 0.5
from the rotamer's library file
Change all radius vanderwals 0 to 0 . 5 from the rotamer ' s library file
"""
    Change all radius vanderwals 0 to 0.5
    from the rotamer's library file
  """
rotamer_library
radius_vdw_info
start_index
end_index