16 dependents
| Package | Description | Downloads/month |
|---|---|---|
| 15K | ||
| do the performance test of ABACUS | 5K | |
| cp2k postprocessing tools | 3K | |
| APEX: Alloy Properties EXplorer using simulations | 1K | |
| A script to build reference datasets for training neural network potentials from... | 1K | |
| DP-GEN: The deep potential generator | 981 | |
| A framework for thermal conductivity calculation based on EMD&NEMD methods | 717 | |
| Operators related to first-principles calculation | 481 | |
| RiD package for enhanced sampling | 467 | |
| Some useful tools related to Amber and DP. | 411 | |
| Abacus agent | 301 | |
| An analyzing tool for Deep Potential based chemical research. | 175 | |
| dpdata plugin for QDπ | 169 | |
| ABACUS agent tools for connecting LLMs to first-principles calculation workflows | 150 | |
| DeepMD-kit integration with Parsl workflow tools to accelerate development of De... | 105 | |
| aesp(Adaptive Evolutionary Structure Predictor) is a crystal structure predictio... | 77 |
