diff --git a/requirements.txt b/requirements.txt index b3fa94465421ee9996da0d653216f47c2ed24062..0546b93dbabb827ad209c98a3ea9835931a39fe3 100755 --- a/requirements.txt +++ b/requirements.txt @@ -1,5 +1,5 @@ future -numpy +numpy cython Pint==0.7.2 ase==3.12.0 @@ -7,3 +7,4 @@ setuptools scipy mdtraj==1.7.2 pandas +pyyaml