8 results found Sort:

81
565
bsd-2-clause
19
⚗ A package useful for chemistry written in Python
Created 2015-05-25
849 commits to master branch, last one 9 months ago
57
175
lgpl-2.1
14
a unified framework for modeling chemically reactive systems
Created 2017-03-20
9,429 commits to main branch, last one 2 months ago
29
104
artistic-2.0
21
COPASI is a software application for simulation and analysis of biochemical networks and their dynamics.
Created 2012-06-27
17,223 commits to develop branch, last one 6 months ago
106
99
gpl-3.0
20
Catalyst Micro-kinetic Analysis Package for automated creation of micro-kinetic models used in catalyst screening
Created 2013-09-12
656 commits to master branch, last one 7 months ago
54
87
gpl-3.0
13
General purpose tools for high-throughput catalysis
Created 2017-10-10
257 commits to master branch, last one 2 years ago
20
83
mit
8
Chemical Reaction Neural Network
Created 2020-12-12
55 commits to main branch, last one 5 months ago
⚛️📈 Create and analyze chemical microkinetic models built from computational chemistry data. Crafted at the @geem-lab.
Created 2019-10-11
744 commits to main branch, last one 12 days ago
A Differentiable Reacting Flow Simulation Package in PyTorch
Created 2020-05-05
132 commits to master branch, last one 3 years ago