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    • jaqpot-inference serves as a server for the jaqpotpy code, exposing it as an API.
      Python
      GNU General Public License v3.0
      0001Updated Oct 25, 2024Oct 25, 2024
    • jaqpotpy

      Public
      Open-source Python client for deploying models and obtaining predictions via the Jaqpot API.
      Python
      MIT License
      11301Updated Oct 25, 2024Oct 25, 2024
    • Open-source RESTful API for managing and deploying models, providing predictions via API, built with Spring Boot and Kotlin.
      Kotlin
      GNU General Public License v3.0
      0000Updated Oct 25, 2024Oct 25, 2024
    • The Jaqpot project's frontend app serves as the interactive gateway for users to engage with our predictive modeling platform.
      TypeScript
      GNU General Public License v3.0
      0000Updated Oct 24, 2024Oct 24, 2024
    • R
      1001Updated Oct 24, 2024Oct 24, 2024
    • This repository contains code for developing PBK model for PFAS under the SCENARIOS H2020 project
      Jupyter Notebook
      Creative Commons Zero v1.0 Universal
      1000Updated Oct 24, 2024Oct 24, 2024
    • The next.js repo for the landing page on jaqpot.org
      TypeScript
      MIT License
      0000Updated Oct 23, 2024Oct 23, 2024
    • Automated end-to-end tests for the Jaqpot platform, using Playwright to validate UI interactions and core functionalities, ensuring platform reliability.
      TypeScript
      0000Updated Oct 21, 2024Oct 21, 2024
    • 0000Updated Oct 17, 2024Oct 17, 2024
    • This repository contains code for the diploma thesis of Alexandros Angelis
      Jupyter Notebook
      MIT License
      0000Updated Sep 17, 2024Sep 17, 2024
    • Python
      GNU General Public License v3.0
      0001Updated Jul 28, 2024Jul 28, 2024
    • D-PINNs

      Public
      Python
      0000Updated Jul 23, 2024Jul 23, 2024
    • Jaqpotpy Torch Inference is a web server designed to run pretrained PyTorch models and return inference results. This server provides a simple API to perform predictions using your pretrained models.
      Python
      0000Updated Jul 15, 2024Jul 15, 2024
    • A keycloak with custom themes added
      Dockerfile
      0000Updated Jul 11, 2024Jul 11, 2024
    • This repository contains code related to the automation of modeling efforts for the PINK project, focusing on training Graph Neural Networks (GNNs) for molecular property prediction from SMILES.
      Python
      0100Updated Jun 28, 2024Jun 28, 2024
    • Angular platform for crafting molecular models and providing predictions, enhancing research capabilities.
      TypeScript
      GNU General Public License v3.0
      0004Updated Jun 18, 2024Jun 18, 2024
    • jaqpot-api-archived

      Public archive
      JAQPOT Quattro is the 4th version of a YAQP, a RESTful web service which can be used to train machine learning models and use them to obtain toxicological predictions for given chemical compounds or engineered nano materials. The project is written in Java8 and JEE7.
      Java
      Other
      4814Updated Apr 29, 2024Apr 29, 2024
    • JavaScript
      0000Updated Apr 19, 2024Apr 19, 2024
    • .github

      Public
      Profile readme
      0000Updated Apr 18, 2024Apr 18, 2024
    • quots

      Public
      Go
      Apache License 2.0
      0000Updated Apr 2, 2024Apr 2, 2024
    • Dockerfile
      MIT License
      0000Updated Apr 2, 2024Apr 2, 2024
    • jaqpotr

      Public
      This repository contains the finalized R client for jaqpot
      R
      Other
      0000Updated Mar 30, 2024Mar 30, 2024
    • This repository contains code for the paper..
      R
      MIT License
      0000Updated Mar 30, 2024Mar 30, 2024
    • QSAR_PFAS

      Public
      This model contains code and data for developing QSAR models in the SCENARIOS project
      Jupyter Notebook
      Creative Commons Zero v1.0 Universal
      1000Updated Mar 29, 2024Mar 29, 2024
    • This repository contains code for developing biokinetics model for PFAS under the SCENARIOS H2020 project
      R
      Creative Commons Zero v1.0 Universal
      0000Updated Mar 14, 2024Mar 14, 2024
    • This repository contains the code for reproducing the results of Tsiros et al. (2023)
      R
      0000Updated Mar 6, 2024Mar 6, 2024
    • This repository contains the code that is relevant to the training of the Jaqpot public models. These are 22 ML/AI models, trained on the data of the Therapeutics Data Commons ADME-Tox (ADMET) Benchmark group and are suitable for small molecule drug discovery.
      Python
      MIT License
      2511Updated Feb 20, 2024Feb 20, 2024
    • jaqpotpy-archived

      Public archive
      Standardized molecular modeling
      Python
      MIT License
      1010Updated Dec 22, 2023Dec 22, 2023
    • httk-app

      Public
      TypeScript
      0008Updated Oct 11, 2023Oct 11, 2023
    • This repository contains functions for developing, testing and validating PBK and other biokinetic models
      R
      MIT License
      0000Updated Aug 7, 2023Aug 7, 2023