BASF

MolPipeline

mopti

Lightweight tools for experimental design and multi-objective optimization.

svelte-spectre

UI-kit based on *spectre.css* and powered by *svelte*

ARCANA

Package for the early-stage analysis and lifecycle monitoring of battery degradation

doe

Python package for flexible generation of D-optimal experimental designs

metis-backend

Scientific server implementation for the cloud environment

metis-gui

Modular standalone fat-client GUI for X-ray diffraction data simulations, analysis, and sharing

pyTEM

Control and Automation of Transmission Electron Microscopes

metis-bff

Backend-for-frontend for Metis

pytopas

Bruker's TOPAS X-ray diffraction calculations parser

reactflush

Create a visual overview of all reactive elements in your Shiny app

riboCleaner

EPPOontology

Ontology for the respresentation of the information available in the EPPO Global Database.

precomplex_generator

The precomplex generator is a tool for obtaining suitable input structures for automated transition-state (TS) searches (precomplexes) based on single-ended reaction path optimization algorithms.

mbo

rormula

Formula parser and evaluator for Wilkinson Notation and dataframes arithmetics

rzentra

An R client for Zentra Cloud API

expression_explorer

rfieldclimate

An R client for Fieldclimate API

rweatherlink

An R client for the weatherlink API

neural-fingerprint-uncertainty

pore_forming_protein_DLM

EnzSolvStab

Studying Enzyme stability in organic co-solvents

.github

mace

MACE - Fast and accurate machine learning interatomic potentials with higher order equivariant message passing.

mgsm_analyze

rarable

R Client for arable.com API

shinyshval