Integrate gpytorch wrapper

ATOMScience-org / AMPL

The ATOM Modeling PipeLine (AMPL) is an open-source, modular, extensible software pipeline for building and sharing models to advance in silico drug discovery.

MIT License

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Integrate gpytorch wrapper #340

Closed andrewkallai closed 3 months ago

andrewkallai commented 4 months ago

This is work completed from the UD-ATOM Hackathon. The purpose is to integrate GPyTorch functionality into AMPL.

paulsonak commented 3 months ago

Thanks!