Repositories list

• docker-rdkit

  Public
  Lightweight RDKit images for production deployment

  dockerfiledocker-imagerdkit+ 1lightweight-images

  Shell

  •

  Apache License 2.0

  •10•33•0•2•Updated Nov 16, 2024Nov 16, 2024

• squonk2-openapi-js-client-generator

  Public
  TypeScript client generator for OpenAPI files. GitHub Action to generate, build & publish a client with docs!

  JavaScript

  •

  MIT License

  •0•1•6•12•Updated Nov 15, 2024Nov 15, 2024

• squonk2-data-manager-ui

  Public
  Web UI for the Squonk Data Manager

  squonk2

  TypeScript

  •

  Apache License 2.0

  •0•2•38•13•Updated Nov 15, 2024Nov 15, 2024

• ansible-infrastructure

  Public
  Ansible logic for Kubernetes infrastructure provisioning

  Jinja

  •0•1•0•3•Updated Nov 15, 2024Nov 15, 2024

• squonk2-data-manager-jupyter-operator

  Public
  A Kubernetes operator for Jupyer

  k8s-operatorsquonk2

  Python

  •

  Apache License 2.0

  •0•0•4•0•Updated Nov 15, 2024Nov 15, 2024

• squonk2-data-manager-job-operator

  Public
  An arbitrary Job-execution operator for the Data Manager API

  k8s-operatorsquonk2

  Python

  •

  MIT License

  •0•0•0•0•Updated Nov 15, 2024Nov 15, 2024

• fragmentor

  Public
  Fragment network build optimisation

  Python

  •1•2•6•0•Updated Nov 15, 2024Nov 15, 2024

• virtual-screening

  Public
  Virtual screening tools and Squonk2 jobs

  squonk2squonk2-jobs

  Python

  •

  Apache License 2.0

  •2•4•0•0•Updated Nov 13, 2024Nov 13, 2024

• squonk2-data-manager-js-client

  Public
  Generates a JS client and docs for the Squonk Data Manager API

  squonk2

  MIT License

  •0•2•0•1•Updated Nov 12, 2024Nov 12, 2024

• docker-neo4j-ansible

  Public
  Ansible Playbooks (and Roles) for docker-neo4j

  Jinja

  •

  Apache License 2.0

  •0•0•0•1•Updated Nov 12, 2024Nov 12, 2024

• docker-neo4j

  Public
  A specialised build of neo4j used by a number of projects

  Shell

  •3•0•5•0•Updated Nov 12, 2024Nov 12, 2024

• squonk2-data-manager-workflow-engine

  Public
  The Schema and Decoder for Data Manager Workflows

  squonk2

  Python

  •

  MIT License

  •0•0•0•0•Updated Nov 8, 2024Nov 8, 2024

• fragnet-ansible

  Public
  Ansible Playbooks (and Roles) to support fragnet

  Jinja

  •

  Apache License 2.0

  •0•0•0•1•Updated Nov 6, 2024Nov 6, 2024

• squonk2-account-server-js-client

  Public
  Generates a JS client and docs for the Account Server API

  squonk2

  MIT License

  •0•1•0•0•Updated Nov 5, 2024Nov 5, 2024

• fragmentor-k8s-orchestration

  Public
  Ansible playbooks for kubernetes deployment of the fragmentor

  Jinja

  •0•0•0•0•Updated Nov 4, 2024Nov 4, 2024

• squonk-ansible

  Public
  Ansible playbooks and roles to deploy Squonk (to Kubernetes)

  Jinja

  •

  Apache License 2.0

  •0•0•1•1•Updated Oct 30, 2024Oct 30, 2024

• squonk2-protobuf

  Public
  Informatics Matters cross-product protocol buffers

  squonk2

  Python

  •

  MIT License

  •0•0•0•0•Updated Oct 28, 2024Oct 28, 2024

• postgresql-ansible

  Public
  A (simple) PostgreSQL deployment

  Jinja

  •0•0•0•0•Updated Sep 10, 2024Sep 10, 2024

• data-manager-job-template

  Public template
  Template repo for Data Manager Job implementations

  squonk2-jobs

  Python

  •

  MIT License

  •1•1•0•0•Updated Aug 15, 2024Aug 15, 2024

• squonk2-python-cl-tools

  Public
  squonk2

  Python

  •

  MIT License

  •0•0•0•0•Updated Aug 12, 2024Aug 12, 2024

• squonk2-python-client

  Public
  Data Manager API Utilities

  squonk2

  Python

  •

  MIT License

  •0•0•0•0•Updated Aug 12, 2024Aug 12, 2024

• squonk2-job-image-tag-checker-action

  Public
  A GitHub Action to check Squonk2 Job container versions

  squonk2squonk2-jobs

  Python

  •

  Apache License 2.0

  •0•0•0•0•Updated Jul 31, 2024Jul 31, 2024

• squonk2-data-manager-job-tester

  Public
  A test utility for Data Manager Job repositories

  squonk2

  Python

  •

  MIT License

  •0•0•3•0•Updated Jul 31, 2024Jul 31, 2024

• squonk2-data-manager-job-decoder

  Public
  Provides decoding capabilities for Job definitions

  squonk2

  Python

  •

  MIT License

  •0•0•0•0•Updated Jul 30, 2024Jul 30, 2024

• squonk2-deck

  Public
  A textual summary of Squonk2 environments

  squonk2

  Python

  •

  MIT License

  •0•0•0•0•Updated Jul 30, 2024Jul 30, 2024

• squonk2-chemaxon

  Public
  squonk2-jobs

  Java

  •

  Apache License 2.0

  •0•0•0•0•Updated Jul 9, 2024Jul 9, 2024

• bandr

  Public
  (PostgreSQL) Backup and recovery container images (OpenShift)

  Python

  •1•0•0•0•Updated Jul 4, 2024Jul 4, 2024

• smokeping-prober-ansible

  Public
  Ansible scripts to deploy SmokePing

  Jinja

  •0•0•0•0•Updated May 24, 2024May 24, 2024

• squonk2-jaqpot

  Public
  A Squonk2 Data Manager Job Repository for Jaqpot model execution

  squonk2squonk2-jobs

  Python

  •

  MIT License

  •0•0•0•0•Updated Apr 23, 2024Apr 23, 2024

• trigger-ci-action

  Public
  A GitHub Action to trigger CI build

  Python

  •

  Apache License 2.0

  •0•3•0•0•Updated Apr 22, 2024Apr 22, 2024