lammps-deepmd
A tool and knowledge base for running molecular dynamics (MD) simulations in LAMMPS with the DeePMD-kit plugin. It handles input script preparation, ensemble selection (NVE/NVT/NPT), and execution with a verified DeePMD-enabled runtime.
Why this score
This repo hosts 8 skills, so its 2,062 stars are split between them (about 258 each) for scoring.
Popularity score: 75/100 from public GitHub signals only. It shows how widely used and maintained this is, not how well it works. Not included yet: the fake-star check. The security scan is shown separately and doesn't change the score. How we rank
Security
Scanned Oct 21, 2026 at commit 4f78c2d0de34, with Cisco's open-source skill-scanner.
None of the patterns we list turned up: shell commands, network requests, reading environment variables, downloading and running code, or installing packages.
A scan lists patterns in the code. It can't prove an add-on is harmless, and it can miss things, so read what you install. How we scan
Alternatives
Other makers' add-ons that do the same job, next to this one.
| Name | Score | Stars | Context | Updated |
|---|---|---|---|---|
| This onelammps-deepmd deepmodeling/deepmd-kit · Skill | 75 | ★ 2.1k | ≈63 always | 16d ago |
| deepmd-python-inference jinzhezenggroup/computational-chemistry-agent-skills · Skill Both about deepmd and dee | 61 | ★ 153 | ≈108 always | 16d ago |