Repositories list

• engine

  Public
  Jupyter Notebook

  •

  MIT License

  •11 fork•11 star•11 issue•00 pull requests•Updated Jul 6, 2026Jul 6, 2026

• spaya-api-v2-client

  Public
  Sample client code to use Spaya API

  Jupyter Notebook

  •

  MIT License

  •00 forks•00 stars•00 issues•00 pull requests•Updated May 14, 2026May 14, 2026

• molecule-representation

  Public
  Interactif molecule representations / drawing as react components

  reacttypescriptchemistry+ 3

  reacttypescriptchemistrycheminformaticsrdkitmolecule-viewer

  TypeScript

  •

  MIT License

  •11 fork•1010 stars•33 issues•00 pull requests•Updated Feb 18, 2026Feb 18, 2026

• rdkit-provider

  Public
  instantiate an RDKit web worker in a React context

  reacttypescriptcheminformatics+ 4

  reacttypescriptcheminformaticsrdkitwebworkerwebworkersrdkit-chem

  TypeScript

  •

  MIT License

  •00 forks•66 stars•44 issues•11 pull request•Updated Feb 18, 2026Feb 18, 2026

• makya-api-tester

  Public
  Python

  •

  MIT License

  •00 forks•00 stars•00 issues•00 pull requests•Updated Dec 8, 2025Dec 8, 2025

• tactical-scheduling

  Public
  Python

  •

  Other

  •00 forks•44 stars•00 issues•00 pull requests•Updated Nov 24, 2025Nov 24, 2025

• growing_linking_optimizers

  Public
  Python

  •00 forks•11 star•11 issue•00 pull requests•Updated Jul 31, 2025Jul 31, 2025

• pymakya-doc

  Public
  HTML

  •

  MIT License

  •00 forks•00 stars•00 issues•00 pull requests•Updated May 27, 2025May 27, 2025

• ketcher

  Public
  Web-based molecule sketcher

  TypeScript

  •

  Apache License 2.0

  •254254 forks•00 stars•00 issues•00 pull requests•Updated Dec 23, 2024Dec 23, 2024

• structure-interactions

  Public
  Python

  •

  GNU General Public License v2.0

  •00 forks•33 stars•00 issues•00 pull requests•Updated Dec 10, 2024Dec 10, 2024

• generation-under-synthetic-constraint

  Public
  Jupyter Notebook

  •

  MIT License

  •44 forks•2020 stars•00 issues•00 pull requests•Updated Nov 12, 2024Nov 12, 2024

• pyspaya

  Public
  Python client for Spaya

  Python

  •

  MIT License

  •11 fork•22 stars•00 issues•00 pull requests•Updated Nov 8, 2024Nov 8, 2024

• makya-api-gateway

  Public
  Sample deployment of the API gateway on client infrastructure

  00 forks•00 stars•00 issues•00 pull requests•Updated Apr 20, 2024Apr 20, 2024

• makya-api-sa-score

  Public
  Sample API for Makya to compute the SA Score

  Python

  •00 forks•00 stars•00 issues•00 pull requests•Updated Apr 19, 2024Apr 19, 2024

• scaffold-hopping

  Public
  Large-step Scaffold Hopping Benchmark

  00 forks•44 stars•00 issues•00 pull requests•Updated Mar 5, 2024Mar 5, 2024

• hiplot

  Public archive
  HiPlot makes understanding high dimensional data easy

  TypeScript

  •

  MIT License

  •148148 forks•11 star•00 issues•00 pull requests•Updated Feb 9, 2024Feb 9, 2024

• simulator-predictor-hacking

  Public
  Jupyter Notebook

  •

  MIT License

  •00 forks•77 stars•00 issues•00 pull requests•Updated Sep 23, 2022Sep 23, 2022

• k8s-gpu-sharing-plugin

  Public
  Forked from https://gitlab.com/nvidia/kubernetes/device-plugin

  Go

  •

  Apache License 2.0

  •00 forks•11 star•00 issues•00 pull requests•Updated Apr 26, 2022Apr 26, 2022

• k8s-gpu-share-plugin

  Public
  GPU Sharing plugin based on NVIDIA device plugin for Kubernetes

  Go

  •

  Apache License 2.0

  •842842 forks•00 stars•00 issues•00 pull requests•Updated Apr 22, 2022Apr 22, 2022

• simple-scorer

  Public
  Simple external scorer using RDKit for Makya

  JavaScript

  •

  MIT License

  •00 forks•00 stars•00 issues•00 pull requests•Updated Nov 18, 2021Nov 18, 2021