%global _empty_manifest_terminate_build 0
Name: python-foundry-ml
Version: 0.6.3
Release: 1
Summary: Package to support simplified application of machine learning models to datasets in materials science
License: MIT License
URL: https://github.com/MLMI2-CSSI/foundry
Source0: https://mirrors.aliyun.com/pypi/web/packages/b8/07/cf4adbb29ea6020fe528de44e2ac9955a939c47a2ebc458caa93bc29cf82/foundry_ml-0.6.3.tar.gz
BuildArch: noarch
Requires: python3-mdf-forge
Requires: python3-globus-sdk
Requires: python3-dlhub-sdk
Requires: python3-numpy
Requires: python3-pandas
Requires: python3-pydantic
Requires: python3-mdf-connect-client
Requires: python3-h5py
Requires: python3-json2table
%description
[](https://pypi.python.org/pypi/foundry_ml)
[](https://github.com/MLMI2-CSSI/foundry/actions/workflows/tests.yml)
[](https://github.com/MLMI2-CSSI/foundry/actions/workflows/python-publish.yml)
[](https://www.nsf.gov/awardsearch/showAward?AWD_ID=1931306&HistoricalAwards=false)
[](https://ai-materials-and-chemistry.gitbook.io/foundry/)
Foundry-ML simplifies the discovery and usage of ML-ready datasets in materials science and chemistry providing a simple API to access even complex datasets.
* Load ML-ready data with just a few lines of code
* Work with datasets in local or cloud environments.
* Publish your own datasets with Foundry to promote community usage
* (in progress) Run published ML models without hassle
Learn more and see our available datasets on [Foundry-ML.org](https://foundry-ml.org/)
# Documentation
Information on how to install and use Foundry is available in our documentation [here](https://ai-materials-and-chemistry.gitbook.io/foundry/v/docs/).
DLHub documentation for model publication and running information can be found [here](https://dlhub-sdk.readthedocs.io/en/latest/servable-publication.html).
# Quick Start
Install Foundry-ML via command line with:
`pip install foundry_ml`
You can use the following code to import and instantiate Foundry-ML, then load a dataset.
```python
from foundry import Foundry
f = Foundry(index="mdf")
f = f.load("10.18126/e73h-3w6n", globus=True)
```
If running this code in a notebook, a table of metadata for the dataset will appear:
We can use the data with `f.load_data()` and specifying splits such as `train` for different segments of the dataset, then use matplotlib to visualize it.
```python
res = f.load_data()
imgs = res['train']['input']['imgs']
desc = res['train']['input']['metadata']
coords = res['train']['target']['coords']
n_images = 3
offset = 150
key_list = list(res['train']['input']['imgs'].keys())[0+offset:n_images+offset]
fig, axs = plt.subplots(1, n_images, figsize=(20,20))
for i in range(n_images):
axs[i].imshow(imgs[key_list[i]])
axs[i].scatter(coords[key_list[i]][:,0], coords[key_list[i]][:,1], s = 20, c = 'r', alpha=0.5)
```
[See full examples](./examples)
# Primary Support
This work was supported by the National Science Foundation under NSF Award Number: 1931306 "Collaborative Research: Framework: Machine Learning Materials Innovation Infrastructure".
# Other Support
Foundry-ML brings together many components in the materials data ecosystem. Including [MAST-ML](https://mastmldocs.readthedocs.io/en/latest/), the [Data and Learning Hub for Science](https://www.dlhub.org) (DLHub), and the [Materials Data Facility](https://materialsdatafacility.org) (MDF).
## MAST-ML
This work was supported by the National Science Foundation (NSF) SI2 award No. 1148011 and DMREF award number DMR-1332851
## The Data and Learning Hub for Science (DLHub)
This material is based upon work supported by Laboratory Directed Research and Development (LDRD) funding from Argonne National Laboratory, provided by the Director, Office of Science, of the U.S. Department of Energy under Contract No. DE-AC02-06CH11357.
https://www.dlhub.org
## The Materials Data Facility
This work was performed under financial assistance award 70NANB14H012 from U.S. Department of Commerce, National Institute of Standards and Technology as part of the [Center for Hierarchical Material Design (CHiMaD)](http://chimad.northwestern.edu). This work was performed under the following financial assistance award 70NANB19H005 from U.S. Department of Commerce, National Institute of Standards and Technology as part of the Center for Hierarchical Materials Design (CHiMaD). This work was also supported by the National Science Foundation as part of the [Midwest Big Data Hub](http://midwestbigdatahub.org) under NSF Award Number: 1636950 "BD Spokes: SPOKE: MIDWEST: Collaborative: Integrative Materials Design (IMaD): Leverage, Innovate, and Disseminate".
https://www.materialsdatafacility.org
%package -n python3-foundry-ml
Summary: Package to support simplified application of machine learning models to datasets in materials science
Provides: python-foundry-ml
BuildRequires: python3-devel
BuildRequires: python3-setuptools
BuildRequires: python3-pip
%description -n python3-foundry-ml
[](https://pypi.python.org/pypi/foundry_ml)
[](https://github.com/MLMI2-CSSI/foundry/actions/workflows/tests.yml)
[](https://github.com/MLMI2-CSSI/foundry/actions/workflows/python-publish.yml)
[](https://www.nsf.gov/awardsearch/showAward?AWD_ID=1931306&HistoricalAwards=false)
[](https://ai-materials-and-chemistry.gitbook.io/foundry/)
Foundry-ML simplifies the discovery and usage of ML-ready datasets in materials science and chemistry providing a simple API to access even complex datasets.
* Load ML-ready data with just a few lines of code
* Work with datasets in local or cloud environments.
* Publish your own datasets with Foundry to promote community usage
* (in progress) Run published ML models without hassle
Learn more and see our available datasets on [Foundry-ML.org](https://foundry-ml.org/)
# Documentation
Information on how to install and use Foundry is available in our documentation [here](https://ai-materials-and-chemistry.gitbook.io/foundry/v/docs/).
DLHub documentation for model publication and running information can be found [here](https://dlhub-sdk.readthedocs.io/en/latest/servable-publication.html).
# Quick Start
Install Foundry-ML via command line with:
`pip install foundry_ml`
You can use the following code to import and instantiate Foundry-ML, then load a dataset.
```python
from foundry import Foundry
f = Foundry(index="mdf")
f = f.load("10.18126/e73h-3w6n", globus=True)
```
If running this code in a notebook, a table of metadata for the dataset will appear:
We can use the data with `f.load_data()` and specifying splits such as `train` for different segments of the dataset, then use matplotlib to visualize it.
```python
res = f.load_data()
imgs = res['train']['input']['imgs']
desc = res['train']['input']['metadata']
coords = res['train']['target']['coords']
n_images = 3
offset = 150
key_list = list(res['train']['input']['imgs'].keys())[0+offset:n_images+offset]
fig, axs = plt.subplots(1, n_images, figsize=(20,20))
for i in range(n_images):
axs[i].imshow(imgs[key_list[i]])
axs[i].scatter(coords[key_list[i]][:,0], coords[key_list[i]][:,1], s = 20, c = 'r', alpha=0.5)
```
[See full examples](./examples)
# Primary Support
This work was supported by the National Science Foundation under NSF Award Number: 1931306 "Collaborative Research: Framework: Machine Learning Materials Innovation Infrastructure".
# Other Support
Foundry-ML brings together many components in the materials data ecosystem. Including [MAST-ML](https://mastmldocs.readthedocs.io/en/latest/), the [Data and Learning Hub for Science](https://www.dlhub.org) (DLHub), and the [Materials Data Facility](https://materialsdatafacility.org) (MDF).
## MAST-ML
This work was supported by the National Science Foundation (NSF) SI2 award No. 1148011 and DMREF award number DMR-1332851
## The Data and Learning Hub for Science (DLHub)
This material is based upon work supported by Laboratory Directed Research and Development (LDRD) funding from Argonne National Laboratory, provided by the Director, Office of Science, of the U.S. Department of Energy under Contract No. DE-AC02-06CH11357.
https://www.dlhub.org
## The Materials Data Facility
This work was performed under financial assistance award 70NANB14H012 from U.S. Department of Commerce, National Institute of Standards and Technology as part of the [Center for Hierarchical Material Design (CHiMaD)](http://chimad.northwestern.edu). This work was performed under the following financial assistance award 70NANB19H005 from U.S. Department of Commerce, National Institute of Standards and Technology as part of the Center for Hierarchical Materials Design (CHiMaD). This work was also supported by the National Science Foundation as part of the [Midwest Big Data Hub](http://midwestbigdatahub.org) under NSF Award Number: 1636950 "BD Spokes: SPOKE: MIDWEST: Collaborative: Integrative Materials Design (IMaD): Leverage, Innovate, and Disseminate".
https://www.materialsdatafacility.org
%package help
Summary: Development documents and examples for foundry-ml
Provides: python3-foundry-ml-doc
%description help
[](https://pypi.python.org/pypi/foundry_ml)
[](https://github.com/MLMI2-CSSI/foundry/actions/workflows/tests.yml)
[](https://github.com/MLMI2-CSSI/foundry/actions/workflows/python-publish.yml)
[](https://www.nsf.gov/awardsearch/showAward?AWD_ID=1931306&HistoricalAwards=false)
[](https://ai-materials-and-chemistry.gitbook.io/foundry/)
Foundry-ML simplifies the discovery and usage of ML-ready datasets in materials science and chemistry providing a simple API to access even complex datasets.
* Load ML-ready data with just a few lines of code
* Work with datasets in local or cloud environments.
* Publish your own datasets with Foundry to promote community usage
* (in progress) Run published ML models without hassle
Learn more and see our available datasets on [Foundry-ML.org](https://foundry-ml.org/)
# Documentation
Information on how to install and use Foundry is available in our documentation [here](https://ai-materials-and-chemistry.gitbook.io/foundry/v/docs/).
DLHub documentation for model publication and running information can be found [here](https://dlhub-sdk.readthedocs.io/en/latest/servable-publication.html).
# Quick Start
Install Foundry-ML via command line with:
`pip install foundry_ml`
You can use the following code to import and instantiate Foundry-ML, then load a dataset.
```python
from foundry import Foundry
f = Foundry(index="mdf")
f = f.load("10.18126/e73h-3w6n", globus=True)
```
If running this code in a notebook, a table of metadata for the dataset will appear:
We can use the data with `f.load_data()` and specifying splits such as `train` for different segments of the dataset, then use matplotlib to visualize it.
```python
res = f.load_data()
imgs = res['train']['input']['imgs']
desc = res['train']['input']['metadata']
coords = res['train']['target']['coords']
n_images = 3
offset = 150
key_list = list(res['train']['input']['imgs'].keys())[0+offset:n_images+offset]
fig, axs = plt.subplots(1, n_images, figsize=(20,20))
for i in range(n_images):
axs[i].imshow(imgs[key_list[i]])
axs[i].scatter(coords[key_list[i]][:,0], coords[key_list[i]][:,1], s = 20, c = 'r', alpha=0.5)
```
[See full examples](./examples)
# Primary Support
This work was supported by the National Science Foundation under NSF Award Number: 1931306 "Collaborative Research: Framework: Machine Learning Materials Innovation Infrastructure".
# Other Support
Foundry-ML brings together many components in the materials data ecosystem. Including [MAST-ML](https://mastmldocs.readthedocs.io/en/latest/), the [Data and Learning Hub for Science](https://www.dlhub.org) (DLHub), and the [Materials Data Facility](https://materialsdatafacility.org) (MDF).
## MAST-ML
This work was supported by the National Science Foundation (NSF) SI2 award No. 1148011 and DMREF award number DMR-1332851
## The Data and Learning Hub for Science (DLHub)
This material is based upon work supported by Laboratory Directed Research and Development (LDRD) funding from Argonne National Laboratory, provided by the Director, Office of Science, of the U.S. Department of Energy under Contract No. DE-AC02-06CH11357.
https://www.dlhub.org
## The Materials Data Facility
This work was performed under financial assistance award 70NANB14H012 from U.S. Department of Commerce, National Institute of Standards and Technology as part of the [Center for Hierarchical Material Design (CHiMaD)](http://chimad.northwestern.edu). This work was performed under the following financial assistance award 70NANB19H005 from U.S. Department of Commerce, National Institute of Standards and Technology as part of the Center for Hierarchical Materials Design (CHiMaD). This work was also supported by the National Science Foundation as part of the [Midwest Big Data Hub](http://midwestbigdatahub.org) under NSF Award Number: 1636950 "BD Spokes: SPOKE: MIDWEST: Collaborative: Integrative Materials Design (IMaD): Leverage, Innovate, and Disseminate".
https://www.materialsdatafacility.org
%prep
%autosetup -n foundry_ml-0.6.3
%build
%py3_build
%install
%py3_install
install -d -m755 %{buildroot}/%{_pkgdocdir}
if [ -d doc ]; then cp -arf doc %{buildroot}/%{_pkgdocdir}; fi
if [ -d docs ]; then cp -arf docs %{buildroot}/%{_pkgdocdir}; fi
if [ -d example ]; then cp -arf example %{buildroot}/%{_pkgdocdir}; fi
if [ -d examples ]; then cp -arf examples %{buildroot}/%{_pkgdocdir}; fi
pushd %{buildroot}
if [ -d usr/lib ]; then
find usr/lib -type f -printf "\"/%h/%f\"\n" >> filelist.lst
fi
if [ -d usr/lib64 ]; then
find usr/lib64 -type f -printf "\"/%h/%f\"\n" >> filelist.lst
fi
if [ -d usr/bin ]; then
find usr/bin -type f -printf "\"/%h/%f\"\n" >> filelist.lst
fi
if [ -d usr/sbin ]; then
find usr/sbin -type f -printf "\"/%h/%f\"\n" >> filelist.lst
fi
touch doclist.lst
if [ -d usr/share/man ]; then
find usr/share/man -type f -printf "\"/%h/%f.gz\"\n" >> doclist.lst
fi
popd
mv %{buildroot}/filelist.lst .
mv %{buildroot}/doclist.lst .
%files -n python3-foundry-ml -f filelist.lst
%dir %{python3_sitelib}/*
%files help -f doclist.lst
%{_docdir}/*
%changelog
* Tue Jun 20 2023 Python_Bot - 0.6.3-1
- Package Spec generated
](https://ai-materials-and-chemistry.gitbook.io/foundry/)
Foundry-ML simplifies the discovery and usage of ML-ready datasets in materials science and chemistry providing a simple API to access even complex datasets.
* Load ML-ready data with just a few lines of code
* Work with datasets in local or cloud environments.
* Publish your own datasets with Foundry to promote community usage
* (in progress) Run published ML models without hassle
Learn more and see our available datasets on [Foundry-ML.org](https://foundry-ml.org/)
# Documentation
Information on how to install and use Foundry is available in our documentation [here](https://ai-materials-and-chemistry.gitbook.io/foundry/v/docs/).
DLHub documentation for model publication and running information can be found [here](https://dlhub-sdk.readthedocs.io/en/latest/servable-publication.html).
# Quick Start
Install Foundry-ML via command line with:
`pip install foundry_ml`
You can use the following code to import and instantiate Foundry-ML, then load a dataset.
```python
from foundry import Foundry
f = Foundry(index="mdf")
f = f.load("10.18126/e73h-3w6n", globus=True)
```
If running this code in a notebook, a table of metadata for the dataset will appear:
We can use the data with `f.load_data()` and specifying splits such as `train` for different segments of the dataset, then use matplotlib to visualize it.
```python
res = f.load_data()
imgs = res['train']['input']['imgs']
desc = res['train']['input']['metadata']
coords = res['train']['target']['coords']
n_images = 3
offset = 150
key_list = list(res['train']['input']['imgs'].keys())[0+offset:n_images+offset]
fig, axs = plt.subplots(1, n_images, figsize=(20,20))
for i in range(n_images):
axs[i].imshow(imgs[key_list[i]])
axs[i].scatter(coords[key_list[i]][:,0], coords[key_list[i]][:,1], s = 20, c = 'r', alpha=0.5)
```
[See full examples](./examples)
# Primary Support
This work was supported by the National Science Foundation under NSF Award Number: 1931306 "Collaborative Research: Framework: Machine Learning Materials Innovation Infrastructure".
# Other Support
Foundry-ML brings together many components in the materials data ecosystem. Including [MAST-ML](https://mastmldocs.readthedocs.io/en/latest/), the [Data and Learning Hub for Science](https://www.dlhub.org) (DLHub), and the [Materials Data Facility](https://materialsdatafacility.org) (MDF).
## MAST-ML
This work was supported by the National Science Foundation (NSF) SI2 award No. 1148011 and DMREF award number DMR-1332851
## The Data and Learning Hub for Science (DLHub)
This material is based upon work supported by Laboratory Directed Research and Development (LDRD) funding from Argonne National Laboratory, provided by the Director, Office of Science, of the U.S. Department of Energy under Contract No. DE-AC02-06CH11357.
https://www.dlhub.org
## The Materials Data Facility
This work was performed under financial assistance award 70NANB14H012 from U.S. Department of Commerce, National Institute of Standards and Technology as part of the [Center for Hierarchical Material Design (CHiMaD)](http://chimad.northwestern.edu). This work was performed under the following financial assistance award 70NANB19H005 from U.S. Department of Commerce, National Institute of Standards and Technology as part of the Center for Hierarchical Materials Design (CHiMaD). This work was also supported by the National Science Foundation as part of the [Midwest Big Data Hub](http://midwestbigdatahub.org) under NSF Award Number: 1636950 "BD Spokes: SPOKE: MIDWEST: Collaborative: Integrative Materials Design (IMaD): Leverage, Innovate, and Disseminate".
https://www.materialsdatafacility.org
%package -n python3-foundry-ml
Summary: Package to support simplified application of machine learning models to datasets in materials science
Provides: python-foundry-ml
BuildRequires: python3-devel
BuildRequires: python3-setuptools
BuildRequires: python3-pip
%description -n python3-foundry-ml