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GitHub / MDSYN2019 / PythonMDScripts
Folder containing the analysis code in C++/Python in MARTINI or SDK
JSON API: https://repos.ecosyste.ms/api/v1/hosts/GitHub/repositories/MDSYN2019%2FPythonMDScripts
Stars: 1
Forks: 0
Open Issues: 35
License: None
Language: Python
Repo Size: 127 MB
Dependencies:
372
Created: over 5 years ago
Updated: over 4 years ago
Last pushed: over 1 year ago
Last synced: about 1 year ago
Topics: molecular-dynamics-simulation, molecular-structures
Files
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Readme
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Dependencies
- Babel ==2.6.0
- Bottleneck ==1.2.1
- Cartopy ==0.17.0
- ChemSpiPy ==2.0.0
- Cython ==0.29.4
- Django ==2.1.5
- Fiona ==1.7.13
- Flask ==1.0.2
- Flask-Cors ==3.0.7
- GDAL ==2.2.4
- GridDataFormats ==0.4.0
- Jinja2 ==2.10
- Keras ==2.2.2
- Keras-Applications ==1.0.4
- Keras-Preprocessing ==1.0.2
- MDAnalysis ==0.19.2
- MMPBSA.py ==16.0
- Mako ==1.0.7
- Markdown ==2.6.11
- MarkupSafe ==1.1.0
- OWSLib ==0.17.1
- OpenEye-toolkits ==2018.10.1
- OpenEye-toolkits-python3-linux-x64 ==2018.10.1
- OpenMM ==7.3.1
- ParmEd ==3.1.0
- Pillow ==5.4.1
- Pint ==0.9
- PubChemPy ==1.0.4
- PyJWT ==1.7.1
- PyScaffold ==3.1
- PySocks ==1.6.8
- PyWavelets ==1.0.1
- PyYAML ==3.13
- Pygments ==2.3.1
- QtAwesome ==0.5.6
- QtPy ==1.6.0
- Rtree ==0.8.3
- SQLAlchemy ==1.2.17
- SecretStorage ==3.1.1
- Send2Trash ==1.5.0
- Shapely ==1.6.4.post2
- Sphinx ==1.8.3
- Theano ==1.0.4
- Werkzeug ==0.14.1
- XlsxWriter ==1.1.2
- absl-py ==0.7.0
- alabaster ==0.7.12
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- asn1crypto ==0.24.0
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- monotonic ==1.5
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- numpy ==1.15.4
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- nvidia-ml-py3 ==7.352.0
- oauthlib ==2.1.0
- odo ==0.5.1
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- openmmtools ==0.17.0
- openmoltools ==0.8.3
- openpyxl ==2.5.14
- packaging ==19.0
- packmol-memgen ==0.9.9a0
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- pickleshare ==0.7.5
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- protobuf ==3.6.1
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- regex ==2018.1.10
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- requests ==2.21.0
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- rope ==0.10.7
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- torch ==1.0.0
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