cjcourt / magdbLinks
Tools for creating a MongoDB collection of ChemDataExtractor-snowball records
☆14Updated 6 years ago
Alternatives and similar repositories for magdb
Users that are interested in magdb are comparing it to the libraries listed below
Sorting:
- Machine learning model for crystal lattice constant prediction☆14Updated 4 years ago
- data and code to reduplicate paper: Topological representations of crystalline compounds for the machine-learning prediction of materials…☆21Updated 4 years ago
- 3-D Inorganic Crystal Structure Generation and Property Prediction via Representation Learning (JCIM 2020)☆41Updated 2 years ago
- Plots for "Machine-learned and codified synthesis parameters of oxide materials" in the journal Scientific Data☆14Updated 8 years ago
- ChemDataExtractor toolkit updated to include semi-supervised quaternary relationship extraction☆13Updated 4 years ago
- Accelerated Design of Layered Materials with Bayesian Optimization☆19Updated 6 years ago
- Codes for text-mined solid-state reactions dataset☆79Updated 2 years ago
- Deep learning for crystal-structure recognition and analysis of atomic structures☆44Updated last year
- A repo of examples for the matminer (https://github.com/hackingmaterials/matminer) code☆116Updated 4 years ago
- Modules for cross validation, evaluation and plot of SISSO☆16Updated 5 years ago
- Unsupervised learning of atomic scale dynamics from molecular dynamics.☆81Updated 3 years ago
- A machine learning environment for atomic-scale modeling in surface science and catalysis.☆116Updated last year
- ☆71Updated 4 years ago
- A Python library for building atomic neural networks☆117Updated 5 months ago
- ☆39Updated 6 years ago
- The functions of superalloyDigger toolkit include batch downloading documents in XML and TXT format from the Elsevier database, locating …☆61Updated 3 months ago
- Extracts tables into json format from HTML/XML files☆37Updated 5 years ago
- Machine Learning Interatomic Potential Predictions☆93Updated last year
- Predict materials properties using only the composition information!☆110Updated 2 years ago
- Deep Learning the Chemistry of Materials From Only Elemental Composition for Enhancing Materials Property Prediction☆97Updated 2 years ago
- Provides some useful information and the LAMMPS input files to model a polymer-metal interface.☆38Updated 3 years ago
- Predict the band gap energy for inorganic materials☆19Updated last year
- Automatic generation of crystal structure descriptions.☆125Updated 2 weeks ago
- Materials Design by Monte Carlo Tree Search☆35Updated 3 years ago
- Machine Learning for High Entropy Alloy☆16Updated 5 years ago
- Python library written in C++ for calculation of local atomic structural environment☆68Updated last year
- MatDeepLearn for DOS prediction☆24Updated 3 years ago
- ☆30Updated 4 years ago
- ☆111Updated 2 years ago
- Composition-Conditioned Crystal GAN pytorch code☆43Updated 3 years ago