tilde-lab/awesome-materials-informatics

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

Size: 155 KB - Last synced at: 3 days ago - Pushed at: 7 months ago - Stars: 437 - Forks: 95

tilde-lab/yascheduler

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

Language: Python - Size: 581 KB - Last synced at: 7 days ago - Pushed at: 22 days ago - Stars: 5 - Forks: 4

tilde-lab/cifplayer

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

Language: TypeScript - Size: 6.63 MB - Last synced at: 15 days ago - Pushed at: 24 days ago - Stars: 26 - Forks: 8

tilde-lab/pyfactxx

Python bindings for upgraded FaCT++ description logic reasoner

Language: Java - Size: 6.6 MB - Last synced at: 15 days ago - Pushed at: 8 months ago - Stars: 24 - Forks: 3

tilde-lab/aiida-dummy

AiiDA plugin for Dummy engine in Yascheduler

Language: Python - Size: 7.81 KB - Last synced at: 13 days ago - Pushed at: 2 months ago - Stars: 1 - Forks: 1

tilde-lab/svelte-spectre-storybook

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

Size: 1.68 MB - Last synced at: about 2 months ago - Pushed at: 3 months ago - Stars: 0 - Forks: 1

tilde-lab/dummy-engine

Sample scientific simulation engine working as a black box

Language: C++ - Size: 22.5 KB - Last synced at: about 2 months ago - Pushed at: over 1 year ago - Stars: 0 - Forks: 1

tilde-lab/pycrystal

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

Language: Python - Size: 311 KB - Last synced at: 14 days ago - Pushed at: 4 months ago - Stars: 12 - Forks: 2

tilde-lab/ml-selection

Language: Python - Size: 4.81 MB - Last synced at: about 2 months ago - Pushed at: 3 months ago - Stars: 0 - Forks: 0

tilde-lab/metis-client

Metis infrastructure API client in Python

Language: Python - Size: 317 KB - Last synced at: 15 days ago - Pushed at: 3 months ago - Stars: 3 - Forks: 1

tilde-lab/aiida-crystal-dft

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

Language: Python - Size: 1.05 MB - Last synced at: 15 days ago - Pushed at: 8 months ago - Stars: 3 - Forks: 4

tilde-lab/optimade.science

A "sky-scanner" Optimade browser-only GUI

Language: Svelte - Size: 2.31 MB - Last synced at: about 20 hours ago - Pushed at: 11 months ago - Stars: 8 - Forks: 4

tilde-lab/chemdoodle-optimade-app

Example Optimade integration of the iChemLabs visualizer

Language: JavaScript - Size: 247 KB - Last synced at: about 1 month ago - Pushed at: 9 months ago - Stars: 2 - Forks: 0

tilde-lab/sql_visualization

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

Language: Python - Size: 9.83 MB - Last synced at: about 2 months ago - Pushed at: over 1 year ago - Stars: 2 - Forks: 1

tilde-lab/OWL2Vec-Star Fork of KRR-Oxford/OWL2Vec-Star

Embedding OWL ontologies

Language: Python - Size: 71 MB - Last synced at: 5 months ago - Pushed at: about 1 year ago - Stars: 0 - Forks: 0

tilde-lab/ml-playground

Language: Jupyter Notebook - Size: 1.03 MB - Last synced at: about 1 year ago - Pushed at: about 1 year ago - Stars: 3 - Forks: 0

tilde-lab/svelte-spectre Fork of basf/svelte-spectre

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

Language: Svelte - Size: 6.89 MB - Last synced at: about 1 year ago - Pushed at: over 1 year ago - Stars: 0 - Forks: 0

tilde-lab/metis-bff Fork of basf/metis-bff

Backend-for-frontend for Metis

Language: JavaScript - Size: 1.11 MB - Last synced at: about 1 year ago - Pushed at: over 1 year ago - Stars: 0 - Forks: 0

tilde-lab/Materials-Databases Fork of blaiszik/Materials-Databases

Size: 363 KB - Last synced at: about 1 year ago - Pushed at: over 9 years ago - Stars: 1 - Forks: 0

tilde-lab/metis-gui Fork of basf/metis-gui

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

Language: Svelte - Size: 3.6 MB - Last synced at: about 1 year ago - Pushed at: about 1 year ago - Stars: 0 - Forks: 0

tilde-lab/metis-backend Fork of basf/metis-backend

Scientific server implementation for the cloud environment

Language: Python - Size: 350 KB - Last synced at: about 1 year ago - Pushed at: about 1 year ago - Stars: 0 - Forks: 0

tilde-lab/simple-k-means-visualization 📦

K-means clustering visualization for ab initio materials data

Language: HTML - Size: 345 KB - Last synced at: about 1 year ago - Pushed at: about 9 years ago - Stars: 2 - Forks: 0

tilde-lab/berlinium 📦

Websockets GUI for the Tilde materials simulations database

Language: HTML - Size: 373 KB - Last synced at: about 1 year ago - Pushed at: over 5 years ago - Stars: 1 - Forks: 0

tilde-lab/quantum_esperanto

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

Language: Cython - Size: 723 KB - Last synced at: 15 days ago - Pushed at: about 1 year ago - Stars: 6 - Forks: 1

tilde-lab/metis.science 📦

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

Language: Svelte - Size: 7.37 MB - Last synced at: about 1 year ago - Pushed at: over 1 year ago - Stars: 1 - Forks: 2

tilde-lab/tilde 📦

Materials informatics framework for ab initio data repositories

Language: Python - Size: 56 MB - Last synced at: 7 days ago - Pushed at: over 2 years ago - Stars: 18 - Forks: 4

tilde-lab/optimade-client

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

Language: TypeScript - Size: 521 KB - Last synced at: 15 days ago - Pushed at: almost 2 years ago - Stars: 5 - Forks: 1

tilde-lab/jsmol-optimade-app

Example Optimade integration of the JSMol visualizer

Language: JavaScript - Size: 3.5 MB - Last synced at: about 2 months ago - Pushed at: almost 3 years ago - Stars: 1 - Forks: 0

tilde-lab/docker-aiida-crystal

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

Language: TSQL - Size: 53.7 KB - Last synced at: about 2 months ago - Pushed at: over 4 years ago - Stars: 0 - Forks: 0

tilde-lab/optimade.providers

Curated list of the OPTIMADE providers

Size: 1.95 KB - Last synced at: about 2 months ago - Pushed at: almost 5 years ago - Stars: 1 - Forks: 0