This Garden contains models trained on the OC20 dataset published by FairChem and the Open Catalyst Project. The models in this Garden are full-sized and trained on the full OC20 dataset. Both S2EF and IS2RE models ...
Random forest models of 33 materials properties to provide predictions, error bars, and domain of applicability guidance. Models are trained and executed with the Materials Simulation Toolkit for Machine Learning (MAST-ML) from the UW-Madison Computational Materials Group. This garden also includes three batch execution variants used to screen candidate perovskites.
This garden hosts a suite of PyTorch models (and corresponding TensorRT engines) trained for conservative-to-primitive variable recovery in numerical relativity simulations, specifically tailored ...
This Garden contains models that take free text as input and produce molecular structures as output. Models include: - Chemeleon from Hyunsoo Park and Aron Walsh at University College London - AtomGPT from Kamal Choudhary at the National Institute of Standards and Technology
# "pip install garden-ai" first
from garden_ai import GardenClient
garden_client = GardenClient()
g = garden_client.get_garden("10.26311/ep98-br79")
materials = ['AgI', 'CdTe', 'BN']
# Run the model remotely and retrieve your results
result = g.predict_piezoelectric_displacement(materials)
Garden uses Modal to run models in the cloud and Globus Compute to run models on Research computing clusters. Read our documentation to learn how to publish your models with Garden.
Made Possible By:
Award Abstract #2209892: “Frameworks: Garden: A FAIR Framework for Publishing and Applying AI Models for Translational Research in Science, Engineering, Education, and Industry”
About
This project builds upon work including:
NIST-supported effort to build data services to help material scientists publish and discover data.
An open source ML-ready data access tool for scientists.
Research cyberinfrastructure, developed and operated as a not-for-profit service by the University of Chicago to enable research data transfer, sharing, access, discovery, and automation.