DiffPy-CMI tutorial files for the ADD2019 workshop, ILL, Grenoble
☆12Mar 25, 2019Updated 7 years ago
Alternatives and similar repositories for add2019-diffpy-cmi
Users that are interested in add2019-diffpy-cmi are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- Python bindings to ObjCryst++ Object-Oriented Crystallographic Library☆18Updated this week
- Scripts for building binary release bundle for Linux and Mac.☆11Feb 12, 2024Updated 2 years ago
- Accelerated molecular crystal structure determination from powder diffraction data☆13Jun 20, 2025Updated last year
- Suite of programs to simulate disordered and nanomaterials☆64Jul 31, 2026Updated last week
- Free Objects for Crystallography : Fox / ObjCryst++☆25Updated this week
- Bare Metal GPUs on DigitalOcean Gradient AI • AdPurpose-built for serious AI teams training foundational models, running large-scale inference, and pushing the boundaries of what's possible.
- Crystal structure container and parsers for structure formats.☆40Updated this week
- Python based GUI-Program for integration and exploration of 2D x-ray diffraction images.☆70Updated this week
- Set of scripts for working with Topas☆16Apr 16, 2025Updated last year
- Browser plugin-free CIF visualization: comparison of the open-source engines☆23Jul 17, 2020Updated 6 years ago
- Diffcalc: a diffraction condition calculator for X-ray or neutron diffractometer control☆22Apr 13, 2026Updated 3 months ago
- Official public repository for the XtalOpt crystallographic multi-objective variable-composition evolutionary algorithm☆53Updated this week
- A code to compute the radial distribution function☆21Feb 22, 2019Updated 7 years ago
- Jupyter Book source files for 2022 MSD summer research internship.☆14Jul 10, 2023Updated 3 years ago
- xrayutilities - a package with useful scripts for X-ray diffraction physicists☆100Jul 21, 2026Updated 2 weeks ago
- Deploy to Railway using AI coding agents - Free Credits Offer • AdUse Claude Code, Codex, OpenCode, and more. Autonomous software development now has the infrastructure to match with Railway.
- ☆16Dec 17, 2024Updated last year
- Text mining synthesis information in metal organic framework☆13Aug 25, 2021Updated 4 years ago
- Reads crystallographic cif files and simulates diffraction☆78Sep 15, 2025Updated 10 months ago
- Some scripts and docs that may help in installing Oasys☆11Jan 9, 2024Updated 2 years ago
- TDL☆11Mar 27, 2015Updated 11 years ago
- python wrapper for fdmnes data input/output☆14Feb 16, 2026Updated 5 months ago
- BCDI: tools for pre(post)-processing Bragg coherent X-ray diffraction imaging data☆28Sep 4, 2024Updated last year
- Documentation for the Juno IDE☆13Nov 6, 2021Updated 4 years ago
- Application for Raman Spectroscopy Analysis☆13Jan 24, 2025Updated last year
- Bare Metal GPUs on DigitalOcean Gradient AI • AdPurpose-built for serious AI teams training foundational models, running large-scale inference, and pushing the boundaries of what's possible.
- Generating geometries for electronic structure calculations from CIF files.☆48Mar 23, 2026Updated 4 months ago
- ☆14Jul 28, 2026Updated last week
- Lesson about time complexity and big O notation☆12Sep 13, 2018Updated 7 years ago
- mdlabbook is a markdown-format lab notebook☆11Jan 11, 2017Updated 9 years ago
- ☆15Feb 17, 2025Updated last year
- The social-LSTM code for complete trajectory prediction (20 frames). In this repository, the normalized trajectory and non-normalized tra…☆11Apr 16, 2023Updated 3 years ago
- Larch: Applications and Python Library for Data Analysis of X-ray Absorption Spectroscopy (XAS, XANES, XAFS, EXAFS), X-ray Fluorescence (…☆178Updated this week
- Oasys School☆12Apr 28, 2022Updated 4 years ago
- System configuration and utilities for Linux ⚙☆12Jul 12, 2026Updated 3 weeks ago
- 1-Click AI Models by DigitalOcean Gradient • AdDeploy popular AI models on DigitalOcean Gradient GPU virtual machines with just a single click. Zero configuration with optimized deployments.
- Examples for the freud library.☆15Updated this week
- Lennard-Jones Molecular Dynamics for beginners☆15Sep 20, 2021Updated 4 years ago
- This repository curates open-source models and related resources for the PXRD to crystal structure generation task.☆16Jul 27, 2026Updated 2 weeks ago
- This code deals with MD trajectory from VASP. It calculates lattice parameters, RMSD, and coordination number and also generates .xyz out…☆11Oct 11, 2021Updated 4 years ago
- Python3 script to create Voronoi tessellations (mosaic pattern) on images☆10May 25, 2019Updated 7 years ago
- Implementation of Differentiable Molecular Simulations with torchMD.☆15Oct 9, 2023Updated 2 years ago
- Estimate the self-diffusion coefficient of a trajectory with a Generalized Least Squares (GLS) optimization procedure.☆17Aug 12, 2022Updated 3 years ago