Forschungszentrum Jülich
13CFLUX
13CFLUX - third-generation, high-performance simulation engine for isotopically stationary and non-stationary 13C metabolic flux analysis within an open, extensible software ecosystem.
- Biotechnology
- Fluxomics
- Isotope labeling
- + 6
- C++
- Python
- CMake
- + 2
AI4HPC
AI4HPC, part of CoE RAISE, is an open-source library to train AI models with CFD datasets on HPC systems. AI4HPC also includes a benchmarking suite to test the limits of any system with CPUs and GPUs towards Exascale and a HyperParameter Optimization (HPO) suite for scalable HPO tasks.
- Artificial Intelligence
- Computational Fluid Dynamics
- CPU
- + 4
AiiDA-KKR
This AiiDA plugin provides high-throughput automation and FAIR data management for the Jülich KKR codes.
- Data Visualization
- FAIR Data
- Information
- + 4
- Python
- Shell
- OpenEdge ABL
AiiDA-Spirit
AiiDA plugin for FAIR high-throughput spin-dynamics simulations with the Spirit code (http://spirit-code.github.io/).
- data managment
- Data Visualization
- FAIR Data
- + 5
- JavaScript
- Python
- HTML
- + 1
Alice2Modelica
This tool allows for the automated generation and calibration of white-box modelica room models based on a room description in the mini-language Modelica.
- Energy
- ESD
- ESD - Topic 2
- + 3
- Python
Alpaca
Alpaca (Automated Lightweight Provenance Capture) captures the provenance during the execution of Python scripts that process data and stores the information using a data model based on the the W3C PROV standard.
- FAIR Data
- Information
- metadata
- + 3
- Python
Arbor
Arbor is a high-performance library for computational neuroscience simulations with multi-compartment, morphologically-detailed cells, from single cell models to very large networks. Arbor is written from the ground up to help neuroscientists effectively use contemporary and future HPC systems.
- GPU
- High performance computing
- Neural network
- + 4
- C++
- AGS Script
- Python
- + 7
ARTIST
AI-enhanced differentiable Ray Tracer for Irradiation Prediction in Solar Tower Digital Twins
- Concentrated Solar Energy
- Differentiable Ray Tracing
- digital twin
- + 5
- Python
AutoGaitA
AutoGaitA streamlines and standardises kinematic analyses of any species performing any rhythmic behaviour, such as walking, swimming or flying. AutoGaitA analyses the kinematics of body coordinate time series data obtained in 2D or 3D with marker-less or marker-based methods.
- biology
- Gait
- Locomotion
- + 3
- Python
CADET
CADET provides hierarchical models, efficient solvers and computational engineering tools for a range of biotechnological processes, including chromatography, filtration, crystallization, and fermentation.
- adsorption
- chromatography
- compartment modelling
- + 4
- C++
- CMake
- C
- + 5
calibr8
calibr8 is a Python toolbox for likelihood-based calibration modeling and Bayesian inference. It supports uni- and multivariate problems, continuous & discrete distributions and includes ready to use models for many non-linear problems. It integrates with PyMC for advanced Bayesian inference.
- Calibration
- Data analysis
- Earth & Environment
- + 4
- Python
case-e
case-e is an open-source electronic case report form (eCRF) system for designing clinical studies and collecting structured research data. It supports configurable forms, validation, role-based access, audit trails, versioning, and portable exports for transparent, FAIR-oriented research workflows.
- BIDS
- Biomedical Ontologies
- Clinical Research
- + 9
- Vue
- Python
- JavaScript
- + 4