Tilde

awesome-materials-informatics

Curated list of known efforts in materials informatics, i.e. in modern materials science

cifplayer

Minimalistic and fast HTML5 visualization of chemical structures in CIF, POSCAR, and OPTIMADE formats

metis-client

Metis infrastructure API client in Python

optimade-client

Isomorphic TypeScript / JavaScript client to aggregate all the official Optimade providers

optimade.science

A "sky-scanner" Optimade browser-only GUI

pycrystal

Utilities for ab initio modeling suite CRYSTAL, developed in Turin University

pyfactxx

Python bindings for upgraded FaCT++ description logic reasoner

quantum_esperanto

Very fast parser for the XML logs produced with the VASP, Vienna Ab initio Simulation Package

tilde

Materials informatics framework for ab initio data repositories

yascheduler

Yet another cloud computing scheduler for the high-throughput cloud scientific simulations

tilde-lab/awesome-materials-informatics

Curated list of known efforts in materials informatics, i.e. in modern materials science

tilde-lab/pyfactxx

Python bindings for upgraded FaCT++ description logic reasoner

tilde-lab/cifplayer

Minimalistic and fast HTML5 visualization of chemical structures in CIF, POSCAR, and OPTIMADE formats

tilde-lab/tilde

Materials informatics framework for ab initio data repositories

tilde-lab/pycrystal

Utilities for ab initio modeling suite CRYSTAL, developed in Turin University

tilde-lab/optimade.science

A "sky-scanner" Optimade browser-only GUI

tilde-lab/quantum_esperanto

Very fast parser for the XML logs produced with the VASP, Vienna Ab initio Simulation Package

tilde-lab/optimade-client

Isomorphic TypeScript / JavaScript client to aggregate all the official Optimade providers

tilde-lab/yascheduler

Yet another cloud computing scheduler for the high-throughput cloud scientific simulations

tilde-lab/aiida-crystal-dft

AiiDA plugin for the ab initio modeling suite CRYSTAL, developed in Turin University

tilde-lab/metis-client

Metis infrastructure API client in Python

tilde-lab/chemdoodle-optimade-app

Example Optimade integration of the iChemLabs visualizer

tilde-lab/ml-playground

tilde-lab/pytopas

Bruker's TOPAS X-ray diffraction calculations parser

tilde-lab/simple-k-means-visualization

K-means clustering visualization for ab initio materials data

tilde-lab/sql_visualization

Generate entity-relationship diagrams from PostgreSQL by PlantUML, DBML-renderer, ERAlchemy, etc.

tilde-lab/svelte-spectre

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

tilde-lab/aiida-dummy

AiiDA plugin for Dummy engine in Yascheduler

tilde-lab/berlinium

Websockets GUI for the Tilde materials simulations database

tilde-lab/dummy-engine

Sample scientific simulation engine working as a black box

tilde-lab/jsmol-optimade-app

Example Optimade integration of the JSMol visualizer

tilde-lab/metis.science

Metis promo website built on the Metis GUI kit *svelte-spectre*

tilde-lab/optimade.providers

Curated list of the OPTIMADE providers

tilde-lab/ml-selection

tilde-lab/docker-aiida-crystal

A docker-compose multicontainer AiiDA setup for CRYSTAL17 code (inspired by docker-aiida-qepw).

tilde-lab/metis-backend

Scientific server implementation for the cloud environment

tilde-lab/metis-bff

Backend-for-frontend for Metis

tilde-lab/metis-gui

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

tilde-lab/OWL2Vec-Star

Embedding OWL ontologies

tilde-lab/svelte-spectre-storybook

Demo website of the Metis GUI kit *svelte-spectre*