Tutorials for DeepModeling projects.
☆18Mar 11, 2026Updated 7 months ago
Alternatives and similar repositories for tutorials
Users that are interested in tutorials are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- Graphics Processing Units Molecular Dynamics☆13Updated this week
- Correlation: A high-performance, Material Design GUI tool for the structural and dynamic analysis of liquids, amorphous solids, and cryst…☆22Updated this week
- eXtended Equivairant Graph Neural Network☆17Jul 23, 2025Updated last year
- An AiiDA workflow that implements a fully automated active learning scheme to train a neural network interatomic potential☆14Jul 2, 2026Updated 3 months ago
- 高通量建立vasp模型和批量分析模型性质（High throughput VASP model and batch analysis model properties）☆13Aug 23, 2021Updated 5 years ago
- Wordpress hosting with auto-scaling - Free Trial Offer • AdFully Managed hosting for WordPress and WooCommerce businesses that need reliable, auto-scalable performance. Cloudways SafeUpdates now available.
- DeepModeling community content☆98Oct 23, 2026Updated last week
- Veidt is a deep learning library for materials science.☆18May 5, 2020Updated 6 years ago
- Analysis of EXAFS Spectra using AI☆19Jul 2, 2023Updated 3 years ago
- 2nd generation of the Deep Potential GENerator☆43Updated this week
- POST code for second order elastic constant☆47Apr 14, 2020Updated 6 years ago
- Coarse-graining library that implements Force-matching☆11Aug 31, 2020Updated 6 years ago
- Computational High-Entropy Alloy Tools☆11May 1, 2023Updated 3 years ago
- A library for 1-dimensional density functional theory (DFT) calculations and analysis.☆14Apr 5, 2023Updated 3 years ago
- a package for developing machine learning-based chemically accurate energy and density functional models☆120Apr 28, 2025Updated last year
- 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.
- extract third order force constants from TDEP output☆10Jun 22, 2020Updated 6 years ago
- ☆11Aug 11, 2016Updated 10 years ago
- Chiraltube is a small python code that prints atomic coordinates for different nanotube and nanoribbon structures in special .xyz files f…☆15Apr 20, 2026Updated 6 months ago
- Extended XYZ specification and parsers☆27Oct 2, 2026Updated 3 weeks ago
- ☆12Nov 28, 2023Updated 2 years ago
- metallocage construction and binding affinity calculations☆18May 30, 2023Updated 3 years ago
- SC21_DP_Tutorial☆10Nov 15, 2021Updated 4 years ago
- Python Cp2k interface☆105Jun 7, 2022Updated 4 years ago
- Code repository for a tutorial based on the "Direct prediction of phonon density of states with Euclidean neural networks"☆31Nov 11, 2023Updated 2 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.
- 三国杀卡牌制作器纯HTML版，来源贴吧，做了些小修改☆10Jun 13, 2024Updated 2 years ago
- The deep potential generator to generate a deep-learning based model of interatomic potential energy and force field☆403Sep 17, 2026Updated last month
- 📈 Uptime monitor and status page for Suliman Sharif, powered by @upptime☆19Updated this week
- ☆13May 28, 2026Updated 5 months ago
- ☆23Apr 16, 2020Updated 6 years ago
- Crystal Edge Graph Attention Neural Network☆25Jun 17, 2024Updated 2 years ago
- A script to build reference datasets for training neural network potentials from given LAMMPS trajectories.☆44Oct 19, 2026Updated last week
- Tutorial for the usage of the dcTMD approach and Langevin simulations employing the trypsin-benzamidine complex as example.☆11Jul 15, 2024Updated 2 years ago
- Python tools to handle CP2K output files☆55Updated this week
- Open source password manager - Proton Pass • AdSecurely store, share, and autofill your credentials with Proton Pass, the end-to-end encrypted password manager trusted by millions.
- ☆15Jan 30, 2022Updated 4 years ago
- Interfacial heat conductance☆14Sep 7, 2024Updated 2 years ago
- Input files for Batzner, S., Musaelian, A., Sun, L., Geiger, M., Mailoa, J. P., Kornbluth, M., ... & Kozinsky, B. (2021). E(3)-equivarian…☆16Jul 3, 2025Updated last year
- DMFF (Differentiable Molecular Force Field) is a Jax-based python package that provides a full differentiable implementation of molecular…☆200Jul 21, 2026Updated 3 months ago
- ☆10Feb 10, 2022Updated 4 years ago
- Transformer in Chemical Language Model sometimes misunderstands chirality☆13Apr 19, 2024Updated 2 years ago
- Dflow is a Python framework for constructing scientific computing workflows (e.g. concurrent learning workflows) employing Argo Workflows…☆84Updated this week