/doc/ase/io/opls.py

https://gitlab.com/vote539/ase · Python · 3 lines · 1 code · 1 blank · 1 comment · 0 complexity · bfdba3fb5ddaffc1434f24b071cfc002 MD5 · raw file 

    

  1. # creates lmp_atoms lmp_opls lmp_in
    2. 

  2. 

  3. exec(compile(open('write_lammps.py').read(), 'write_lammps.py', 'exec'))
    4.