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IMSI hands-on workshop: Latent Space Simulators
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andrewlferguson/IMSI_LSS
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Download all files in this repo to your local disk via
Code -> Download zip (GUI option)
orgit clone https://github.com/andrewlferguson/IMSI_LSS.git(CLI option)Direct your web browser tohttps://colab.research.google.com/
Sign in with your Google account
Navigate to File -> Upload notebook, and upload ADP_backbone_LSS.ipynb
Within active colab notebook, navigate to Edit -> Notebook settings, and select a GPU hardware accelerator
Execute notebook cell by cell (click "play" button to left of each cell or
Shift+Enter)
GitHub:
https://github.com/Ferg-Lab/LSS
Paper:
@article{sidky2020molecular, title={Molecular latent space simulators}, author={Sidky, Hythem and Chen, Wei and Ferguson, Andrew L}, journal={Chemical Science}, volume={11}, number={35}, pages={9459--9467}, year={2020}, publisher={Royal Society of Chemistry}}