OpenChemistry/avogadrodata OpenChemistry/avogadrodata

  • Stars
    star
    4
  • Rank 3,304,323 (Top 66 %)
  • Language
    Shell
  • Created over 12 years ago
  • Updated 9 months ago
Twitter logo Share LinkedIn logo Share Facebook logo Share
OpenChemistry/avogadrodata
github

OpenChemistry

Reviews

There are no reviews yet. Be the first to send feedback to the community and the maintainers!

Repository Details

Repository for support data used by the Open Chemistry projects (including Avogadro 2)

More Repositories

1

avogadrolibs

Avogadro libraries provide 3D rendering, visualization, analysis and data processing useful in computational chemistry, molecular modeling, bioinformatics, materials science, and related areas.
C++
450
star
2

tomviz

Cross platform, open source application for the processing, visualization, and analysis of 3D tomography data
C++
317
star
3

avogadroapp

Avogadro is an advanced molecular editor designed for cross-platform use in computational chemistry, molecular modeling, bioinformatics, materials science, and related areas.
C++
181
star
4

openchemistry

Supermodule containing submodules and external project to build all components
CMake
80
star
5

chemicaljson

Development of the Chemical JSON data representation
Python
63
star
6

molequeue

Desktop integration of high performance computing resources
C++
25
star
7

stempy

Toolkit for 4D STEM processing on HPC using a Python interface and C++ engine. https://stempy.readthedocs.io/
C++
22
star
8

crystals

Crystallographic files of common materials, elements, oxides, for visualization in Avogadro
16
star
9

mongochem

Qt MongoDB desktop cheminformatics application - this project is no longer active
C++
15
star
10

molecules

Common molecule fragments for visualization in Avogadro
15
star
11

mongochemserver

Server code for MongoChem chemical data
Python
15
star
12

tomviz-superbuild

Superbuild to make packaging simpler for Tomviz
Shell
11
star
13

avogenerators

Python input file generators for Avogadro 2
Python
11
star
14

mongochemclient

Web client code for the MongoChem project
JavaScript
10
star
15

jupyter-examples

Provide some example JupyterLab notebooks showing off independent Open Chemistry components
Jupyter Notebook
9
star
16

oc-web-components

Web components supporting the Open Chemistry project
JavaScript
8
star
17

openchemistrypy

Python
7
star
18

materialsdatabank

An information portal for 3D atomic electron tomography data
JavaScript
7
star
19

mongochemdeploy

Scripts to install/deploy the MongoChem server/web client
Python
7
star
20

openqube

C++
6
star
21

fragments

Molecular fragments and inorganic ligands for rapidly building structures
Python
6
star
22

oremda

Open Reproducible Electron Microscopy Data Analysis
Python
5
star
23

protocall

C++
5
star
24

distiller

Python
4
star
25

certbot-rancher

Images to use certbot in Rancher environment without elevated privileges.
Shell
3
star
26

jupyterlab_cjson

JavaScript
3
star
27

tomvizdocs

Tomviz documentation hosted on readthedocs.io
3
star
28

avogadro-ugm2018

Materials for the 2018 Avogadro Users Group Meeting
Python
2
star
29

avogadro-commands

Example default command scripts for Avogadro 2
Python
2
star
30

avogadro-cclib

Python script plugin to import files through cclib
Python
1
star
31

tomviztutorial

Tutorial slides on the use of Tomviz
JavaScript
1
star
32

composition-plot

TypeScript
1
star
33

edp

A platform for the ingestion and management of experimental data.
JavaScript
1
star
34

tomvizweb

Tomviz web code supporting the Tomviz desktop application for web export of data
JavaScript
1
star
35

avogadro-i18n

Translations for Avogadro app and libraries
1
star
36

stemserver

Server code for 4D STEM visualization and data processing
Python
1
star
37

VisItBridge

Copy of VisItBridge
C
1
star