wontleave

Institute of Sustainability for Chemicals, Energy and Environment Singapore

Pinned Repositories

avogadro
Avogadro is an advanced molecular editor designed for cross-platform use in computational chemistry, molecular modeling, bioinformatics, materials science, and related areas. It offers flexible rendering and a powerful plugin architecture.
Language:C++0 1 00
bii-4th-workshop-KCW
Repository for the 4th BII workshop
0 1 00
GeneticAlgorithmPython
Source code of PyGAD, a Python 3 library for building the genetic algorithm and training machine learning algorithms (Keras & PyTorch).
Language:Python0 0 00
orca5processor
A post-processor for Orca 5 and other packages
Language:Python00
pymatgen_learn
Scritpts to post-process VASP with pymatgen
Language:Python2 1 00
tinydft
A minimalistic atomic Density Functional Theory (DFT) code
Language:Python0 0 01

wontleave/pymatgen_learn
Scritpts to post-process VASP with pymatgen
Language:Python2 1 00
wontleave/avogadro
Avogadro is an advanced molecular editor designed for cross-platform use in computational chemistry, molecular modeling, bioinformatics, materials science, and related areas. It offers flexible rendering and a powerful plugin architecture.
Language:C++0 1 00
wontleave/bii-4th-workshop-KCW
Repository for the 4th BII workshop
0 1 00
wontleave/GeneticAlgorithmPython
Source code of PyGAD, a Python 3 library for building the genetic algorithm and training machine learning algorithms (Keras & PyTorch).
Language:Python0 0 00
wontleave/orca5processor
A post-processor for Orca 5 and other packages
Language:Python00
wontleave/tinydft
A minimalistic atomic Density Functional Theory (DFT) code
Language:Python0 0 01