A literature database
☆83Apr 7, 2026Updated 3 months ago
Alternatives and similar repositories for litdb
Users that are interested in litdb are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- X3D for Atomic Simulation Environment☆15Nov 8, 2020Updated 5 years ago
- MatID is a Python package for identifying and analyzing atomistic systems based on their structure.☆14Jul 6, 2026Updated 3 weeks ago
- ☆15Feb 5, 2025Updated last year
- ☆16Jan 22, 2026Updated 6 months ago
- ☆75Jun 17, 2026Updated last month
- Managed hosting for WordPress and PHP on Cloudways • AdManaged hosting for WordPress, Magento, Laravel, or PHP apps, on multiple cloud providers. Deploy in minutes on Cloudways by DigitalOcean.
- A symbolic regression engine for jax☆40Jul 3, 2026Updated 3 weeks ago
- Course notes for the CMU course 06-262 Math Methods of Chemical Engineering (ODE's, linear algebra, PDEs, stats) in the form of jupyter n…☆26Oct 19, 2022Updated 3 years ago
- Alchemical machine learning interatomic potentials☆36Nov 8, 2024Updated last year
- Reproduction of CGCNN for predicting material properties☆28Jul 7, 2026Updated 3 weeks ago
- ☆13Nov 9, 2025Updated 8 months ago
- Strategies for the Construction of Neural-Network Based Machine-Learning Potentials (MLPs)☆29May 1, 2021Updated 5 years ago
- State Manager for Thermodynamic Properties☆12Sep 4, 2025Updated 10 months ago
- Uncertainty quantification (UQ) for Machine-Learning Interatomic Potentials (MLIPs)☆30Jun 9, 2026Updated last month
- ☆12Sep 9, 2020Updated 5 years ago
- Managed hosting for WordPress and PHP on Cloudways • AdManaged hosting for WordPress, Magento, Laravel, or PHP apps, on multiple cloud providers. Deploy in minutes on Cloudways by DigitalOcean.
- [HYU-Mechanical Engineering] Thermo Fluid Dynamics Experiment Lecture Code☆35Nov 22, 2023Updated 2 years ago
- This is the source code for paper "Neural Network Potentials for Accelerated Metadynamics of Oxygen Reduction Kinetics at Au-Water Interf…☆24Jun 5, 2024Updated 2 years ago
- An ASE-friendly implementation of the amorphous-to-crystalline (a2c) workflow.☆18Oct 19, 2025Updated 9 months ago
- Threaded implementation of grid-based Bader charge analysis.☆17Oct 19, 2023Updated 2 years ago
- Evolutionary Monte Carlo algorithm for optimization in chemical space.☆13Feb 9, 2026Updated 5 months ago
- VMD Audio/Text control with natural language☆19May 12, 2021Updated 5 years ago
- A collection of files related to machine learning force fields☆25Oct 25, 2023Updated 2 years ago
- Scripts to extract various properties from VASP OUTCAR file☆12Jul 30, 2023Updated 2 years ago
- ☆13Nov 16, 2022Updated 3 years ago
- Managed hosting for WordPress and PHP on Cloudways • AdManaged hosting for WordPress, Magento, Laravel, or PHP apps, on multiple cloud providers. Deploy in minutes on Cloudways by DigitalOcean.
- Python script to plot periodic trends as a heat map over the periodic table of elements☆119Nov 7, 2025Updated 8 months ago
- Chemistry toolkit for simulating the aqueous speciation of metal-oxo clusters☆11Jul 6, 2026Updated 3 weeks ago
- Extract structure-functions from data using XAI and LLMs☆27Jan 20, 2025Updated last year
- gpaw-tools is a powerful and user-friendly UI/GUI tool for conducting Density Functional Theory (DFT) and molecular dynamics (MD) calcula…☆30Feb 4, 2026Updated 5 months ago
- ☆25May 7, 2026Updated 2 months ago
- Theory Infused Neural Network☆11May 6, 2026Updated 2 months ago
- CrystalGRW: Generative Modeling of Crystal Structures with Targeted Properties via Geodesic Random Walks☆15May 22, 2026Updated 2 months ago
- ☆12Nov 3, 2019Updated 6 years ago
- Course repository for 06-623☆13Mar 31, 2020Updated 6 years ago
- Deploy to Railway using AI coding agents - Free Credits Offer • AdUse Claude Code, Codex, OpenCode, and more. Autonomous software development now has the infrastructure to match with Railway.
- A new python package to visualize molecules in dots hover☆13Feb 15, 2024Updated 2 years ago
- Bayesian optimization for chemistry☆19Mar 20, 2024Updated 2 years ago
- ☆76Mar 19, 2021Updated 5 years ago
- Synthesis generative model☆48Apr 24, 2025Updated last year
- A toolkit for visualizations in materials informatics.☆321Jul 11, 2026Updated 2 weeks ago
- CatBench - Benchmark Framework of Machine Learning Interatomic Potentials in Adsorption Energy Predictions☆57Updated this week
- Python package for calculating thermodynamic potentials from first-principles calculations☆14Dec 22, 2023Updated 2 years ago