pyscal / atomRDFLinks
atomRDF is a python tool for ontology-based creation, manipulation, and querying of structures. atomRDF uses the Computational Material Sample Ontology (CMSO).
☆9Updated 2 weeks ago
Alternatives and similar repositories for atomRDF
Users that are interested in atomRDF are comparing it to the libraries listed below
Sorting:
- The PMD Core Ontology (PMDco) official release repository☆19Updated 2 weeks ago
- The ELN custom schemas from synthesis experiments☆11Updated this week
- Specification of a common REST API for access to materials databases☆92Updated last month
- A NOMAD plugin containing base sections for measurements.☆14Updated 3 weeks ago
- NOMAD lets you manage and share your materials science data in a way that makes it truly useful to you, your group, and the community.☆90Updated this week
- This repository contains organizational notes and details for the CECAM MADICES workshop, 7th-9th February 2022.☆13Updated 3 years ago
- Specification for the ELN File Format☆56Updated this week
- Elementary Multiperspective Material Ontology (EMMO)☆71Updated 2 weeks ago
- MAUD Interface Language Kit (MILK) is a set of Rietveld tools for automated processing of diffraction datasets.☆19Updated 2 months ago
- Standard for interoperable scientific data exchange☆36Updated 9 months ago
- flexible materials modeling and lab automation☆14Updated last month
- A universal file format for gas adsorption experiments☆19Updated last month
- A Working Group on connecting and advancing interoperability of efforts on automated extraction of metadata from materials and chemical f…☆14Updated last year
- Tools for implementing and consuming OPTIMADE APIs in Python☆77Updated this week
- Tools for handling CIF files, and CIF parsers used for the Crystallography Open Database (COD)☆21Updated 2 months ago
- We are developing a configurable measurement software (CAMELS), targeted towards the requirements of experimental solid-state physics. He…☆15Updated last week
- DLite - a lightweight data-centric framework for semantic interoperability☆39Updated 2 weeks ago
- XRay Estimation and Refinement Using Similarity (XERUS)☆33Updated 5 months ago
- Crystal structure container and parsers for structure formats.☆35Updated 2 weeks ago
- Implements core functions for AiiDAlab.☆16Updated last month
- Chemical Methods Ontology☆15Updated last month
- A simple, robust and flexible just-in-time job management framework in Python.☆159Updated this week
- Turbomoleio is a python package containing a set of tools for the generation of inputs and parsing of outputs for the TURBOMOLE quantum c…☆20Updated 6 months ago
- BET Surface Identification - a program that fully implements the rouquerol criteria☆21Updated 2 years ago
- Set of scripts for working with Topas☆16Updated 3 months ago
- jobflow is a library for writing computational workflows.☆104Updated this week
- Analysis of Molecular Dynamics output in the IPython Notebook☆10Updated 8 years ago
- The IUPAC WorldFAIR Cookbook for FAIR chemical data☆24Updated 2 months ago
- An example repository for creating a nomad distribution with custom plugins.☆10Updated 2 weeks ago
- A repository for the implementation of common workflow interfaces across materials-science codes and plugins☆54Updated 8 months ago