CKannas

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Christos Kannas's starred repositories

PowerToys

Windows system utilities to maximize productivity

Language:C#MIT107088 1140 28265

pytorch

Tensors and Dynamic neural networks in Python with strong GPU acceleration

Language:PythonNOASSERTION80257 1731 43077

barrier

Open-source KVM software

Language:CNOASSERTION26662 257 1505

Cookbook

The Data Engineering Cookbook

Apache-2.013316 538 135

mamba

The Fast Cross-Platform Package Manager

Language:C++BSD-3-Clause6547 47 1656

miniforge

A conda-forge distribution.

Language:ShellNOASSERTION5772 55 340

swifter

A package which efficiently applies any function to a pandas dataframe or series in the fastest available manner

Language:PythonMIT2489 30 147

MinkowskiEngine

Minkowski Engine is an auto-diff neural network library for high-dimensional sparse tensors

Language:PythonNOASSERTION2367 47 541

tensorly

TensorLy: Tensor Learning in Python.

Language:PythonNOASSERTION1522 45 263

installScript

script that installs omv-extras and openmediavault if not installed already.

Language:Shell1035 30 117

d6tflow

Python library for building highly effective data science workflows

Language:PythonMIT951 24 23

teachopencadd

TeachOpenCADD: a teaching platform for computer-aided drug design (CADD) using open source packages and data

Language:Jupyter NotebookCC-BY-4.0709 31 153

wh40k-9e

Warhammer 40,000: 9th Edition

graphql

A GraphQL to Cypher query execution layer for Neo4j and JavaScript GraphQL implementations.

Language:TypeScriptApache-2.0491 58 802

datamol

Molecular Processing Made Easy.

Language:PythonApache-2.0441 17 106

guacamol

Benchmarks for generative chemistry

Language:PythonMIT392 15 15

condacolab

Install Conda and friends on Google Colab, easily

Language:Jupyter NotebookMIT327 5 46

rxnmapper

RXNMapper: Unsupervised attention-guided atom-mapping. Code complementing our Science Advances publication on "Extraction of organic chemistry grammar from unsupervised learning of chemical reactions" (https://advances.sciencemag.org/content/7/15/eabe4166).

Language:PythonMIT276 11 28

ASKCOS

Software package for computer aided synthesis planning

Language:PythonNOASSERTION197 14 20

Pypher

Python Cypher Querybuilder

Language:PythonMIT162 8 42

rxnfp

Reaction fingerprints, atlases and classification. Code complementing our Nature Machine Intelligence publication on "Mapping the space of chemical reactions using attention-based neural networks" (http://rdcu.be/cenmd).

Language:HTMLMIT152 9 15

rdchiral

Wrapper for RDKit's RunReactants to improve stereochemistry handling

Language:Jupyter NotebookMIT148 19 28

dotfiles

Simple dotfiles for winning at git :heavy_exclamation_mark:

Language:Shell138 50

guacamol_baselines

Baselines models for GuacaMol benchmarks

Language:PythonMIT130 8 11

FCD

Fréchet ChemNet Distance: A quality measure for generative models for molecules

Language:PythonLGPL-3.068 8 9

openmediavault-upgrade

Script to upgrade openmediavault from one major release into the next

GPL-3.047 6 33

py4chemoinformatics

Python for chemoinformatics

Language:Jupyter NotebookNOASSERTION47 30

dotfiles

Some of my dotfiles, nothing fancy or worthwhile

Language:Shell30 5 1

neo4jFastAPI

checking neo4j with python

Language:PythonApache-2.010 1 1

wh40k

Warhammer 40,000