Capability details
What this helps you do
Run classical molecular-dynamics simulations of atomic and molecular systems with selected interaction potentials and optional packages.
Catalog editorial description
View description sources
editor · 2026-09-18 — Catalog classification and summary; not maintainer acknowledgement.
Research classification
Physical sciences · Materials engineering
View discipline evidence
editor · 2026-09-18 — 依据原始用途对项目与核心工具提出FORD 1.3、2.5分类；属于科研任务子集，不替代开放科研网络整体定位。
Who it is for
An intended audience has not been supplied. Check the original documentation for suitability and prerequisites.
How to use it
Follow upstream guidance and source conditions.
AIPOCH has not verified execution.
Read usage documentationInputs
- 粒子结构、势函数、边界条件及积分/采样设置。
Outputs
- 粒子轨迹、热力学量等模拟输出。
Resource type
Tool
Access conditions
- 固定README明确GPLv2并读取LICENSE正文，未推断only/or-later。
- 势文件、第三方库和可选包单独审查；经典模型和参数有效性不能由软件可运行推出。
- Community indexing of this software or analysis workflow only. External models, datasets, services and third-party components have separate terms. Installation, scientific accuracy and suitability were not validated.
View usage information sources
Inputs
editor · 2026-09-18 — Catalog classification and summary; not maintainer acknowledgement.
Outputs
editor · 2026-09-18 — Catalog classification and summary; not maintainer acknowledgement.
Access conditions
editor · 2026-09-18 — Catalog classification and summary; not maintainer acknowledgement.
Documentation
editor · 2026-09-18 — Catalog classification and summary; not maintainer acknowledgement.
Sources & versions
- Reference role
- implementation
- Last successful public check
- 2026-09-22T08:38:07.013Z
- Latest public check attempt
- 2026-09-22T08:38:07.013Z · ok
- GitHub metrics
- Stars 3,066 · checked · latest attempt 2026-09-22T08:38:07.013Z (ok)
Forks 2,048 · checked · latest attempt 2026-09-22T08:38:07.013Z (ok) - Latest default-branch commit
df3dba0cae4196f3f4e691785600454fc7ed4a3b
Observed 2026-09-22T08:38:07.013Z- Source activity check
- fresh · last successful check 2026-09-22T08:38:07.013Z · latest attempt 2026-09-22T08:38:07.013Z (ok)
- Source status
- Active at last observation
- License
- GPL-2.0
- Fixed commit
c8bd2ae5927ee236a8892dbd51c18a92cc9c33cf- Reference checked
- 2026-09-18
Default-branch activity is separate from the fixed reference above. Source terms apply. A fixed commit identifies content; it does not establish scientific validity.
Related research
Run classical molecular-dynamics simulations of atomic and molecular systems with selected interaction potentials and optional packages.
Claims & evidence
Continue the conversation
Research questions and code contributions belong with the original project. Catalog corrections can be proposed separately.