markovmodel / adaptivemd

A python framework to run adaptive Markov state model (MSM) simulation on HPC resources
GNU Lesser General Public License v2.1
18 stars 7 forks source link

Fix numpy scalar storage issue #21

Closed jhprinz closed 7 years ago

jhprinz commented 7 years ago

As @thempel discovered the DB could not store numpy scalars and replaced these with None. THis fix replaces numpy scalars with python scalars. If that is problematic this should be enhanced in the future. For now this works.