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A collection of interpretive chemical tools for analyzing outputs of the quantum chemistry calculations.
Updated
May 10, 2024
Python
D3 based interactive visualization library + tool to make render atoms and molecules learning chemical bonding in a fun way.
Command Line Interactive Periodic Table of Elements in multiple languages
Updated
Mar 28, 2023
BASIC
Updated
Apr 26, 2020
Python
High performance CUDA/Python library for computing quantum chemistry density-based descriptors for larger systems using GPUs.
Updated
May 14, 2024
Cuda
Utilities for manipulation/translation of input/output formats of quantum-mechanics based electronic structure codes
Updated
Sep 22, 2021
Python
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Molecular viewer [Work in progress]