Alternatives and similar repositories for docker-postgres-rdkit

Users that are interested in docker-postgres-rdkit are comparing it to the libraries listed below

• rdkit / django-rdkit
  ☆55Updated last year
• mcs07 / docker-postgres-rdkit
  PostgreSQL Docker image with RDKit cartridge
  ☆19Updated 5 years ago
• chembience / chembience
  A Docker-based, cloudable platform for the development of chemoinformatics-centric web applications and microservices.
  ☆45Updated 3 months ago
• rvianello / chemicalite
  An SQLite extension for chemoinformatics applications.
  ☆58Updated 6 months ago
• InformaticsMatters / docker-rdkit
  Lightweight RDKit images for production deployment
  ☆35Updated 2 months ago
• rinikerlab / lightweight-registration
  lwreg is a lightweight registration system for chemical registration and data storage.
  ☆76Updated 2 months ago
• teaguesterling / rdalchemy
  RDKit integration to SQLAlchemy
  ☆10Updated 4 years ago
• rvianello / razi
  A cheminformatics extension for the SQLAlchemy database toolkit.
  ☆40Updated 2 years ago
• Steinbeck-Lab / cheminformatics-microservice
  This set of essential and valuable microservices is designed to be accessed via API calls to support cheminformatics.
  ☆51Updated 3 weeks ago
• MolecularAI / reaction_utils
  Utilities for working with datasets of chemical reactions, reaction templates and template extraction.
  ☆78Updated last month
• InformaticsMatters / pipelines
  Containerised components for cheminformatics and computational chemistry
  ☆36Updated 2 years ago
• mcs07 / docker-rdkit
  RDKit Docker images
  ☆20Updated 3 years ago
• cdk / depict
  SMILES Depiction Generator
  ☆59Updated 2 months ago
• pragmatic-streamlit / streamlit-molstar
  ☆73Updated last year
• rdkit / UGM_2023
  Materials from the 2023 RDKit UGM
  ☆34Updated last year
• rdkit / mongo-rdkit
  GSoC 2020 project to integrate the RDKit and MongoDb
  ☆16Updated last year
• chembl / FPSim2
  Simple package for fast molecular similarity searches
  ☆147Updated last week
• aclarkxyz / web_molkit
  Web Molecular Toolkit: cheminformatics functionality in TypeScript
  ☆38Updated last week
• EBjerrum / rdeditor
  Simple RDKit molecule editor GUI using PySide
  ☆158Updated 7 months ago
• nextmovesoftware / molhash
  Create molecular hashes
  ☆27Updated 6 years ago
• xchem / fragalysis-package
  A repo for analysis of ensembles of protein-ligand complexes
  ☆30Updated 7 months ago
• IUPAC-InChI / InChI
  Main InChI repository
  ☆97Updated this week
• matteoferla / molecular_rectifier
  Given an RDKit molecule that does not sanitise, correct it until it does
  ☆41Updated last year
• baoilleach / partialsmiles
  A validating SMILES parser, with support for incomplete SMILES
  ☆29Updated 7 months ago
• apahl / mol_frame
  Chemical Structure Handling for Pandas DataFrames
  ☆33Updated 2 years ago
• mychem / mychem-code
  Mychem is an extension for MySQL that makes possible to use cheminformatics functions within SQL queries.
  ☆21Updated 3 months ago
• chemalot / chemalot
  chemalot: a command-line cheminformatics open-source package
  ☆38Updated 2 years ago
• open-reaction-database / ord-schema
  Schema for the Open Reaction Database
  ☆105Updated 2 months ago
• chembl / chembl_beaker
  RDKit wrapper
  ☆49Updated last year
• nglviewer / mdsrv
  MD trajectory server
  ☆34Updated 2 years ago