Python Computational-science Resources

2021: A Year Full of Amazing AI papers- A Review 📌 A curated list of the latest breakthroughs in AI by release date with a clear video explanation, l

Hub is a dataset format with a simple API for creating, storing, and collaborating on AI datasets of any size. The hub data layout enables rapid transformations and streaming of data while training models at scale. Hub is used by Google, Waymo, Red Cross, Oxford University, and Omdena.

Package Continuous Integration Documentation About AbiPy is a python library to analyze the results produced by Abinit, an open-source program for the

Pyfood is a simple Python package to process food, in different languages. Pyfood's ambition is to be the go-to library to deal with food, recipes, on

DataComPy DataComPy is a package to compare two Pandas DataFrames. Originally started to be something of a replacement for SAS's PROC COMPARE for Pand

CALPHAD tools for designing thermodynamic models, calculating phase diagrams and investigating phase equilibria.

LynxKite is a complete graph data science platform for very large graphs and other datasets. It seamlessly combines the benefits of a friendly graphical interface and a powerful Python API.

🤖 Coeus - EARIST A.C.E 💬 Coeus is an Artificial Conversational Entity for queries in Eulogio "Amang" Rodriguez Institute of Science and Technology,

The neural architecture of language: Integrative modeling converges on predictive processing Code accompanying the paper The neural architecture of la

Practical Data Visualization with Python Overview All views expressed on this site are my own and do not represent the opinions of any entity with whi

neptune-contrib Documentation See neptune-contrib documentation site Installation Get prerequisites python versions 3.5.6/3.6 are supported Install li

This repository contains sample code scripts for creating awesome data visualizations from scratch using different python libraries (such as matplotli

A Boilerplate repo for Scientific Python Open Science projects Installation Clone this repo If you need a fresh python environment, run $ conda env cr

OctaDist Octahedral distortion calculator: A tool for calculating distortion parameters in coordination complexes. https://octadist.github.io/ Registe

AKShare is an elegant and simple financial data interface library for Python, built for human beings

Population Shift Monitoring popmon is a package that allows one to check the stability of a dataset. popmon works with both pandas and spark datasets.

CleverCSV is a Python package for handling messy CSV files. It provides a drop-in replacement for the builtin CSV module with improved dialect detection, and comes with a handy command line application for working with CSV files.

pyscreener A pythonic interface to high-throughput virtual screening software Overview This repository contains the source of pyscreener, both a libra

gdsclient NOTE: This is a work in progress and many GDS features are known to be missing or not working properly. This repo hosts the sources for gdsc

Zero to Mastery Machine Learning Welcome! This repository contains all of the code, notebooks, images and other materials related to the Zero to Maste

Discord DataExtractor 🔮 Discord DataExtractor is a set of scripts that allows you to dig into your Discord Data package. Repository guide ☕ Coffee_Ga

gdsclient This repo hosts the sources for gdsclient, a Python wrapper API for operating and working with the Neo4j Graph Data Science (GDS) library. g

Aviary The aviary contains: - roost, - wren, cgcnn. The aim is to contain multiple models for materials discovery under a common interface Environment

Overview Feast is an open source feature store for machine learning. Feast is the fastest path to productionizing analytic data for model training and

SymEngine Python Wrappers Python wrappers to the C++ library SymEngine, a fast C++ symbolic manipulation library. Installation Pip See License section

Political elections, appointment, analysis and visualization in Python poli-sci-kit is a Python package for political science appointment and election

BERT, LDA, and TFIDF based keyword extraction in Python kwx is a toolkit for multilingual keyword extraction based on Google's BERT and Latent Dirichl

Data-viz utils 📈 Functions for data visualization in matplotlib 📚 API Can be installed using pip install dvu and then imported with import dvu. You

Computational Methods for Physics & Astronomy Book version at: https://restrepo.github.io/ComputationalMethods by: Sebastian Bustamante 2014/2015 Dieg

Cross-Camera Convolutional Color Constancy, ICCV 2021 (Oral) Mahmoud Afifi1,2, Jonathan T. Barron2, Chloe LeGendre2, Yun-Ta Tsai2, and Francois Bleibe

Illumination_Decomposition Code for TIP 2017 paper --- Illumination Decomposition for Photograph with Multiple Light Sources. This code implements the

How useful is the aswer? A Streamlit web-app for a data-science project that aims to evaluate if the answer to a question is helpful. If you want to l

Computational modelling of ray propagation through optical elements using the principles of geometric optics (Ray Tracer) Introduction By applying the

Table of Contents Sherpa License How To Install Sherpa Using Anaconda Using pip Building from source History Release History Sherpa Sherpa is a modeli

Flow Flow is a computational framework for deep RL and control experiments for traffic microsimulation. See our website for more information on the ap

This is a repository for all hackerank challenges kindly note this is for learning purposes and if you wish to contribute, dont hesitate all submision

HETU Documentation | Examples Hetu is a high-performance distributed deep learning system targeting trillions of parameters DL model training, develop

How to apply? Create your config.ini file following the example provided in config.ini Choose one of the options below to run: Run with Python3 pip in

Simulation and Parameter Estimation in Geophysics - A python package for simulation and gradient based parameter estimation in the context of geophysical applications.

The collaboration platform for Machine Learning MLReef is an open source ML-Ops platform that helps you collaborate, reproduce and share your Machine

Clustering Clustering Application in Python Using scikit-learn This repository contains the prediction of baseball metric clusters using MLB Statcast

Wooey is a simple web interface to run command line Python scripts. Think of it as an easy way to get your scripts up on the web for routine data anal

Random database/dataframe generator Authored and maintained by Dr. Tirthajyoti Sarkar, Fremont, USA Introduction Often, beginners in SQL or data scien

easyNeuron is a simple way to create powerful machine learning models, analyze data and research cutting-edge AI.

Programmatically Build and Manage Training Data Announcement The Snorkel team is now focusing their efforts on Snorkel Flow, an end-to-end AI applicat

deepdish Flexible HDF5 saving/loading and other data science tools from the University of Chicago. This repository also host a Deep Learning blog: htt

rows No matter in which format your tabular data is: rows will import it, automatically detect types and give you high-level Python objects so you can

MDAnalysis Repository README [*] MDAnalysis is a Python library for the analysis of computer simulations of many-body systems at the molecular scale,

Machine Learning for Argument-Based Computational Persuasion This repo contains the source code and a benchmark for predicting user's utilities with M

No non-sense and no BS repo for how data structure code should be in Python - simple and elegant.

A curated list of references for MLOps

The Open-Source MLOps Orchestration Framework MLRun is an open-source MLOps framework that offers an integrative approach to managing your machine-lea

ZenML is an extensible, open-source MLOps framework to create production-ready machine learning pipelines. It has a simple, flexible syntax, is cloud and tool agnostic, and has interfaces/abstractions that are catered towards ML workflows.

Flyte Flyte is a workflow automation platform for complex, mission-critical data, and ML processes at scale Home Page · Quick Start · Documentation ·

Pachyderm: The Data Foundation for Machine Learning Pachyderm provides the data layer that allows machine learning teams to productionize and scale th

A toolkit for computational pathology and machine learning. View documentation Please cite our paper Installation There are several ways to install Pa

geneticml This package contains a simple and lightweight genetic algorithm for optimization of any machine learning model. Installation Use pip to ins

Model Validation Toolkit is a collection of tools to assist with validating machine learning models prior to deploying them to production and monitoring them after deployment to production.

Applied Machine Learning for Graduate Program in Computer Science (PPGCC) - Federal University of Santa Catarina

LitMatter A template for rapid experimentation and scaling deep learning models on molecular and crystal graphs. How to use Clone this repository and

H2G-Net This repository contains the code relevant for the proposed design H2G-Net, which was introduced in the manuscript "Hybrid guiding: A multi-re

Termos e acordos Ao iniciar este projeto, você concorda com as diretrizes do Código de Ética e Conduta e do Manual da Pessoa Estudante da Trybe. Boas

geneticml This package contains a simple and lightweight genetic algorithm for optimization of any machine learning model. Installation Use pip to ins

ML-and-DataScience-preparation This repository has the goal to create a learning and preparation roadMap for Machine Learning Engineers and Data Scien

Viz-It Data Visualizer Web-Application If I ask you where most of the data wrangler looses their time ? It is Data Overview and EDA. Presenting "Viz-I

Ultra-Fast Force Fields (UF3) S. R. Xie, M. Rupp, and R. G. Hennig, "Ultra-fast interpretable machine-learning potentials", preprint arXiv:2110.00624

A website for courses of Major Computer Science, NKU

Sacred Every experiment is sacred Every experiment is great If an experiment is wasted God gets quite irate Sacred is a tool to help you configure, or

sklearn-evaluation Machine learning model evaluation made easy: plots, tables, HTML reports, experiment tracking, and Jupyter notebook analysis. Suppo

plotly_resampler enables visualizing large sequential data by adding resampling functionality to Plotly figures. In this Plotly-Resampler demo over 11

A simple API for working with University of California, Irvine (UCI) Machine Learning (ML) repository Table of Contents Introduction About Page of the

Surveying Attack Models for CAVs Guide to Installing CARLA and Collecting Data Our project focuses on surveying attack models for Connveced Autonomous

Latent Semantic Analysis Pipeline for training LSA models using Scikit-Learn. Usage Instead of writing custom code for latent semantic analysis, you j

Learn to Code It is an intiiative undertaken by Student Ambassadors Club, Jamshoro for students who are absolute begineers in programming and want to

miceforest: Fast, Memory Efficient Imputation with lightgbm Fast, memory efficient Multiple Imputation by Chained Equations (MICE) with lightgbm. The

On Memorization in Probabilistic Deep Generative Models This repository contains the code necessary to reproduce the experiments in On Memorization in

MatrixProfile MatrixProfile is a Python 3 library, brought to you by the Matrix Profile Foundation, for mining time series data. The Matrix Profile is

An Open Source Project from the Data to AI Lab, at MIT MLPrimitives Pipelines and primitives for machine learning and data science. Documentation: htt

ClimART - A Benchmark Dataset for Emulating Atmospheric Radiative Transfer in Weather and Climate Models Official PyTorch Implementation Using deep le

Few-shot Deep HDR Deghosting This repository contains code and pretrained models for our paper: Self-Gated Memory Recurrent Network for Efficient Scal

tsflex is a toolkit for flexible time series processing & feature extraction, that is efficient and makes few assumptions about sequence data. Useful

IMBENS: class-imbalanced ensemble learning in Python. Links: [Documentation] [Gallery] [PyPI] [Changelog] [Source] [Download] [知乎/Zhihu] [中文README] [a

Variational Gibbs inference (VGI) This repository contains the research code for Simkus, V., Rhodes, B., Gutmann, M. U., 2021. Variational Gibbs infer

Biblioteca em Python que coleta informações cadastrais de empresas do Brasil (CNPJ) obtidas de fontes oficiais (Receita Federal) e exporta para um formato legível por humanos (CSV ou JSON).

Hydrosphere examples This repo contains demo scenarios and pre-trained models to show Hydrosphere capabilities. Data and artifacts management Some mod

The lightweight PyTorch wrapper for high-performance AI research. Scale your models, not the boilerplate. Website • Key Features • How To Use • Docs •

Synapse Machine Learning SynapseML (previously MMLSpark) is an open source library to simplify the creation of scalable machine learning pipelines. Sy

Everything Tech Resources & Projects About The Project Coming from an engineering background and looking to up skill yourself on a new field can be di

Cookiecutter Data Science A logical, reasonably standardized, but flexible project structure for doing and sharing data science work. Project homepage

PandasVault ⁠— Advanced Pandas Functions and Code Snippets The only Pandas utility package you would ever need. It has no exotic external dependencies

PandaPy "I came across PandaPy last week and have already used it in my current project. It is a fascinating Python library with a lot of potential to

A Python API for Intelligent Visual Discovery Lux is a Python library that facilitate fast and easy data exploration by automating the visualization a

Find relative paths from a project root directory Finding project directories in Python (data science) projects, just like there R here and rprojroot

"Dataflow variables are spectacularly expressive in concurrent programming" Henri E. Bal , Jennifer G. Steiner , Andrew S. Tanenbaum Quick overview Ne

Procedural-Maze-Generator-Algorithms Check out my youtube channel : Auctux Ressources Thanks to Jamis Buck Book : Mazes for programmers Requirements P

PyDS CLI Helping you manage your data science projects sanely. Requirements Anaconda/Miniconda/Miniforge/Mambaforge (Mambaforge recommended!) git on y

Generative Adversarial Network - Generating Universe This repository contains part of the code used to make the images visible in the article "How doe

Command line utilities for tabular data files This is a set of command line utilities for manipulating large tabular data files. Files of numeric and

English / Spanish / Korean / Chinese / Bengali / Indonesian The fastai book These notebooks cover an introduction to deep learning, fastai, and PyTorc

Compare MLOps Platforms. Breakdowns of SageMaker, VertexAI, AzureML, Dataiku, Databricks, h2o, kubeflow, mlflow...