Repositories list

• INTERPRET-NTA

  Public
  JavaScript

  •

  Other

  •0•1•0•0•Updated Feb 5, 2026Feb 5, 2026

• cts_celery

  Public
  Celery tasks for CTS p-chem and transformation products data requests.

  Python

  •0•0•0•11•Updated Feb 4, 2026Feb 4, 2026

• cts_app

  Public
  cts repo

  HTML

  •4•5•34•14•Updated Feb 4, 2026Feb 4, 2026

• cts_api

  Public
  JavaScript

  •

  GNU General Public License v3.0

  •0•0•0•21•Updated Feb 4, 2026Feb 4, 2026

• cts_calcs

  Public
  CTS calculators' repository; sub module for ubertool_cts.

  Python

  •0•0•0•0•Updated Feb 4, 2026Feb 4, 2026

• cts_kube

  Public
  Kubernetes stack for CTS components

  Dockerfile

  •0•0•0•0•Updated Jan 28, 2026Jan 28, 2026

• nta_app

  Public
  App for non-targeted analysis of mass spectrometry

  Python

  •1•2•0•5•Updated Dec 31, 2025Dec 31, 2025

• esat-app

  Public
  Desktop application project for ESAT

  Python

  •

  Apache License 2.0

  •2•0•0•0•Updated Nov 14, 2025Nov 14, 2025

• esat

  Public
  EPA's Environmental Source Apportionment Toolkit (ESAT) python package

  Jupyter Notebook

  •

  Apache License 2.0

  •10•22•10•1•Updated Nov 14, 2025Nov 14, 2025

• cts_pkasolver

  Public
  CTS wrapper for pkasolver

  Python

  •0•0•0•3•Updated Oct 15, 2025Oct 15, 2025

• pkasolver

  Public
  toolkit for prediction pKa values of small molecules via graph convolutional networks

  Jupyter Notebook

  •

  MIT License

  •26•0•0•0•Updated Oct 15, 2025Oct 15, 2025

• hydraulic_gradient

  Public
  Hydraulic Gradient Calculator (Dash)

  Python

  •

  Other

  •0•0•0•0•Updated Oct 2, 2025Oct 2, 2025

• MolGpKa

  Public
  The graph-convolutional neural network for pka prediction

  Jupyter Notebook

  •

  MIT License

  •36•0•0•0•Updated Sep 11, 2025Sep 11, 2025

• cts-envipath

  Public
  Code to call the enviPath biotransformation pathway prediction system API for use with CTS.

  Python

  •1•2•0•0•Updated Sep 10, 2025Sep 10, 2025

• OPERAWS

  Public
  Web service wrapper for OPERA - a free and open source QSAR tool for predicting physicochemical properties and environmental fate endpoints

  Python

  •2•2•0•1•Updated Sep 9, 2025Sep 9, 2025

• ctsws

  Public
  Chemical Transformation Simulator (CTS) Metabolizer Web Services (WS) - ctsws

  Java

  •0•0•0•0•Updated Sep 8, 2025Sep 8, 2025

• cts_nginx

  Public
  Nginx Image for Docker, includes Dockerfile and .conf

  Dockerfile

  •0•0•0•0•Updated Sep 8, 2025Sep 8, 2025

• cts_nodejs

  Public
  Handles CTS Frontend web sockets; pushes user data requests' responses to user.

  JavaScript

  •0•1•0•7•Updated Sep 8, 2025Sep 8, 2025

• VPopLib

  Public
  C++

  •0•0•0•0•Updated Aug 26, 2025Aug 26, 2025

• nta_flask

  Public
  Flask restful API for the nta_app backend

  Python

  •0•0•0•0•Updated May 9, 2025May 9, 2025

• hms

  Public
  hydrologic micro-services

  C#

  •5•5•5•4•Updated Mar 28, 2025Mar 28, 2025

• static_qed

  Public
  static css, js, html elements for qed projects

  JavaScript

  •1•0•0•0•Updated Mar 12, 2025Mar 12, 2025

• templates_qed

  Public
  templates for qed django projects

  HTML

  •0•0•0•0•Updated Mar 12, 2025Mar 12, 2025

• qed_nginx

  Public
  nginx configuration within qed

  Dockerfile

  •0•0•0•0•Updated Feb 19, 2025Feb 19, 2025

• hms_app

  Public
  django app for hydrological microservices

  JavaScript

  •0•0•0•1•Updated Feb 13, 2025Feb 13, 2025

• requirements_qed

  Public
  python requirements for qed projects

  Python

  •0•0•0•17•Updated Jan 20, 2025Jan 20, 2025

• vb_kube

  Public
  Virtual Beach Web Kubernetes repo

  Shell

  •0•0•5•0•Updated Dec 3, 2024Dec 3, 2024

• hms_kube

  Public
  HMS kubernetes stack

  Dockerfile

  •0•0•13•0•Updated Nov 25, 2024Nov 25, 2024

• bt_api

  Public
  Biotransformer webservices wrapper for the CLI.

  Python

  •0•0•0•0•Updated Oct 31, 2024Oct 31, 2024

• cyan-waterbody

  Public
  cyan waterbody aggregation code

  Jupyter Notebook

  •0•1•0•0•Updated Oct 17, 2024Oct 17, 2024