kaist-amsg / imatgen
image-based generative model for inverse design of solid state materials
☆39Updated 3 years ago
Alternatives and similar repositories for imatgen:
Users that are interested in imatgen are comparing it to the libraries listed below
- Composition-Conditioned Crystal GAN pytorch code☆43Updated 3 years ago
- Learning to Discover Crystallographic Structures with Generative Adversarial Networks☆38Updated 5 years ago
- ☆26Updated 3 years ago
- Representation Learning from Stoichiometry☆58Updated 2 years ago
- 3-D Inorganic Crystal Structure Generation and Property Prediction via Representation Learning (JCIM 2020)☆41Updated 2 years ago
- "Data-Driven Approach to Encoding and Decoding 3-D Crystal Structures", Jordan Hoffmann, Louis Maestrati, Yoshihide Sawada, Jian Tang, Je…☆35Updated 5 years ago
- Original implementation of CSPML☆23Updated 3 months ago
- ☆28Updated 2 years ago
- A collection of tools and databases for atomistic machine learning☆48Updated 3 years ago
- ☆33Updated 8 months ago
- Zeolite GAN☆21Updated 4 years ago
- ☆30Updated 3 years ago
- Graph neural network potential with charge transfer☆35Updated 2 years ago
- ☆23Updated 7 months ago
- FTCP code☆33Updated last year
- ☆31Updated 4 years ago
- We developed a novel method, MOF-CGCNN, to efficiently and accurately predict the methane the volumetric uptakes at 65 bar for MOFs. Two …☆16Updated 3 years ago
- Python library for the construction of porous materials using topology and building blocks.☆63Updated 3 months ago
- Crystal Edge Graph Attention Neural Network☆19Updated 9 months ago
- Mirror of http://zeoplusplus.org/☆8Updated 6 years ago
- ☆11Updated 2 years ago
- A system for rapid identification and analysis of metal-organic frameworks☆51Updated 3 months ago
- Source code for generating materials with 20 space groups using PGCGM☆33Updated 2 years ago
- Inorganic Reaction Prediction☆12Updated 8 months ago
- ☆22Updated 2 years ago
- Generative materials benchmarking metrics, inspired by guacamol and CDVAE.☆35Updated 9 months ago
- ☆11Updated 4 months ago
- This python code creates hybrid MD/MC (NAMD/GOMC) simulations for the NVT, NPT, GCMC, and GEMC-NVT ensembles☆37Updated 3 weeks ago
- ☆10Updated last year
- An automated enhanced sampling generation of training sets for chemically reactive machine learning interatomic potentials☆15Updated 4 months ago