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Starred repositories
An extremely fast Python package and project manager, written in Rust.
🏆 A ranked list of awesome atomistic machine learning projects ⚛️🧬💎.
Huly — All-in-One Project Management Platform (alternative to Linear, Jira, Slack, Notion, Motion)
Python library for XrdPatterns including file import, file export and postprocessing functionalities
SpectraFox is a free tool for managing, processing, and evaluating scientific scanning probe microscopy (SPM) data-files. For example, data measured by scanning tunneling microscopy (STM) and scann…
Specification of a common REST API for access to materials databases
A NOMAD plugin containing base sections for measurements.
A modular graph-based Retrieval-Augmented Generation (RAG) system
Python library to handle Scanning Probe Microscopy Images. Can read nanoscan .xml data, Bruker AFM images, Nanonis SXM files as well as iontof images(ITA, ITM and ITS).
An example repository for creating a nomad distribution with custom plugins.
End-To-End Molecular Dynamics (MD) Engine using PyTorch
Software tools for reasearch data management on the local desktop, following the KISS principle
RubelMozumder / Near-Earth-Object-Analysis
Forked from udacity/cd0010-advanced-python-techniques-project-starterStarter code for Course 1 of Intermediate Python ND
RubelMozumder / aiida-kkr
Forked from JuDFTteam/aiida-kkrCode containing the AiiDA-KKR plugins and some workflows for the juDFT KKR codes.
AiiDA plugin of the high-performance density functional theory code JuKKR (www.judft.de) for high-throughput electronic structure calculations.