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SciLink Public
Connecting experimental materials science with computational modeling and literature analysis via LLM-powered agents
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gpax Public
Gaussian Processes for Experimental Sciences
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atomai Public
Forked from pycroscopy/atomaiDeep and machine learning for atomic-scale and mesoscale data
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pymatgen Public
Forked from materialsproject/pymatgenPython Materials Genomics (pymatgen) is a robust materials analysis code that defines classes for structures and molecules with support for many electronic structure codes. It powers the Materials …
Python Other UpdatedMay 23, 2025 -
NeuroBayes Public
Fully and Partially Bayesian Neural Nets
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openai-agents-python Public
Forked from openai/openai-agents-pythonA lightweight, powerful framework for multi-agent workflows
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paper-qa Public
Forked from Future-House/paper-qaHigh accuracy RAG for answering questions from scientific documents with citations
Python Apache License 2.0 UpdatedMar 13, 2025 -
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Semi-supervised VAE for data with the rotational disorder
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OpticalNanoImagingML Public
ML analysis of optical nanoimaging and nanospectroscopy data
Jupyter Notebook UpdatedApr 8, 2024 -
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aimsgb Public
Forked from ksyang2013/aimsgbAb-initio Interface Materials Simulation Project for Grain Boundaries (AIMSGB)
PostScript Other UpdatedMar 15, 2024 -
pyroVED Public
Invariant representation learning from imaging and spectral data
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AIML-tutorials Public
Forked from AIMLWG/AIML-tutorialsRepository for containing the tutorial series for the AI/ML working group
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GPim Public
Gaussian processes and Bayesian optimization for images and hyperspectral data
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mace-jax Public
Forked from ACEsuit/mace-jaxEquivariant machine learning interatomic potentials in JAX.
Python UpdatedOct 4, 2023 -
ML-ElectronMicroscopy-2023 Public
Forked from SergeiVKalinin/ML-ElectronMicroscopy-2023Jupyter Notebook UpdatedAug 25, 2023 -
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awesome-self-driving-labs Public
Forked from AccelerationConsortium/awesome-self-driving-labsA curated list of self-driving laboratories that combine hardware automation and artificial intelligence to accelerate scientific discovery.
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ActiveChannelLearning Public
Automated selection of channels with best predictive capacity in multimodal imaging and spectroscopy experiments
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AugmentedGaussianProcess Public
Gaussian process augmented with a probabilistic model of expected system's behavior
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MRS2021 Public
Forked from pycroscopy/MRS2021Notebooks for MRS2021 tutorial
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notebooks_for_medium Public
Jupyter notebooks for our Medium articles
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causal-learn Public
Forked from py-why/causal-learnPython translation (and extension) of the Tetrad java code.
Python UpdatedNov 12, 2021 -
SPM_ML_School_2021 Public
Forked from pycroscopy/SPM_ML_School_2021Virtual School – “Machine Learning and Automated Experiment in Scanning Probe Microscopy" at ORNL, October 4-7, 2021
Jupyter Notebook UpdatedOct 7, 2021 -
DeepReinforcementLearningInAction Public
Forked from DeepReinforcementLearning/DeepReinforcementLearningInActionCode from the Deep Reinforcement Learning in Action book from Manning, Inc
Jupyter Notebook MIT License UpdatedSep 27, 2021
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