VlachosGroup / AIMSim

A Python toolbox to work with molecular similarity
https://vlachosgroup.github.io/AIMSim/README.html
MIT License
30 stars 4 forks source link

```pip install aimsim``` not working on MacOSX #240

Closed himaghna closed 1 year ago

himaghna commented 1 year ago

Trace attached aimsim_macosx_installation_trace.txt

System details: Model Name: MacBook Pro Model Identifier: MacBookPro17,1 Chip: Apple M1 Total Number of Cores: 8 (4 performance and 4 efficiency) Memory: 8 GB System Firmware Version: 7429.81.3 OS Loader Version: 7429.81.3

JacksonBurns commented 1 year ago

From a cursory glance, this seems to be an known issue with numpy and has been fixed since version 1.21.4 -- unfortunately we have fixed out version of numpy to exactly 1.21.0. I will open a PR and experiment with allowing a wider range of numpy versions in particular.