Ruixuefennnian's repositories

pydata-book

Materials and IPython notebooks for "Python for Data Analysis" by Wes McKinney, published by O'Reilly Media

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arpeggio

Calculation of interatomic interactions in molecular structures

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Evolutionary-Algorithm

Evolutionary Algorithm using Python

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django-file-upload-download

Demo code examples for uploading and downloading files using Django, including file renaming, Ajax upload and streaming of large files.

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office-automation

office automation code

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openbabel

Open Babel is a chemical toolbox designed to speak the many languages of chemical data.

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plip

Protein-Ligand Interaction Profiler - Analyze and visualize non-covalent protein-ligand interactions in PDB files

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propka-3.1

PROPKA predicts the pKa values of ionizable groups in proteins and protein-ligand complexes based in the 3D structure.

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pyemma_tutorials

How to analyze molecular dynamics data with PyEMMA

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tennis

ai学习例子

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