bias-correction bias-detection classification ethics fairness fairness-ai fairness-ml machine-learning post-processing responsible-ai

computational-fluid-dynamics post-processing pre-processing vascular

blender blender-addon computational-fluid-dynamics geophysical-fluid-dynamics openfoam post-processing telemac-mascaret

bioinformatics gene-annotation pipeline post-processing

arup city-modelling city-modelling-lab cml post-processing

analyses ch4-flux co2-flux data-correction ecosystem-fluxes eddy-covariance eddypro fluxnet gap-filling h2o-flux jupyter-notebooks n2o-flux outlier-detection plotting post-processing quality-screening random-forest-regression time-series time-series-analysis xgboost-regression

bayesian-statistics data-science deconvolution inverse-problems post-processing reconstruction-algorithm sensor-data

finite-element-analysis opensees openseespy post-processing structural-engineering visualization xara

3D Atomistic simulations Biochemistry Colloidal Self-Assembly Data Structures Mesoscale Modelling and Simulations SAXS Sample atomisitc automation bash biomolecular biomolecular simulation coarse-grain coarse-grained condensed matter equilibration framework free software full atom full-atom git gitlab library molecular aggregates molecular arrangement molecular dynamics molecular modeling molecular structures multiscale multiscale modeling numerical simulation organic molecule physical-chemistry post-processing post-simulation analyses post-simulation analysis python python3 sans sas script self-aggregation self-assembly shape shapes shapespyer simulation simulation-framework smiles notation smiles strings soft matter software development template workflow workflow automation

acf autocorrelation-function autocorrelation-integral characteristic-timescales data-analysis exponential-correlation-time integrated-correlation-time lgpl molecular-dynamics open-source post-processing power-spectral-distribution psd python-package scientific-computing stacie time-correlation transport-properties uncertainty-quantification