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pygraphistry

PyGraphistry is a Python library to quickly load, shape, embed, and explore big graphs with the GPU-accelerated Graphistry visual graph analyzer

pynock

A proposed standard `NOCK` for a Parquet format that supports efficient distributed serialization of multiple kinds of graph technologies

pysmilesutils

pytextrank

Python implementation of TextRank for phrase extraction and summarization of text documents

qsar-drugdiscovery-with-rdkit

ChEMBL Database used to create Lipinski Descriptors (ADME Pharmokinetic Profile) to use in a Random Forest Regression Model

science-parse

Science Parse parses scientific papers (in PDF form) and returns them in structured form.

scitldr

sketchsort-minmax

smplip-score

Prediction of Absolute Ligand-Protein Binding Affinity

streamlit-launchpad

Browse a folder containing multiple streamlit apps and launch them immediately

streamlit_3dmol

streptavidin-biotin-binding-study-using-the-movable-type-method

This repository includes all necessary codes written in octave and all data files applied for the free energy calculation in the work, The Role of the Active Site Flap in Streptavidin/Biotin Complex Formation, published in the Journal of American Chemical Society (J. Am. Chem. Soc., 2018, 140 (16), pp 5434–5446).

torchchem

An experimental repo for experimenting with PyTorch models

torchdrug

A powerful and flexible machine learning platform for drug discovery

wemake-frontend-styleguide

Set of the strictest linters for your next frontend app

wemake-python-package

Bleeding edge cookiecutter template to create new python packages

wemake-python-styleguide

The strictest and most opinionated python linter ever!