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…/computational-chemistry-agent-skills/deepmd-finetune-dpa3
home/skills/jinzhezenggroup/computational-chemistry-agent-skills/deepmd-finetune-dpa3
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deepmd-finetune-dpa3

byjinzhezenggroup· 38 skills

Stars

116

Forks

24

Category

Machine Learning & AI

View on GitHub

TL;DR

Fine-tune a DPA3 model in DeePMD-kit using the PyTorch backend. Use when the user wants to adapt a pre-trained DPA3 model to a new downstream dataset. Supports fine-tuning from a self-trained DPA3 model (.pt checkpoint), from a multi-task pre-trained model, or from a built-in pretrained model downloaded via dp pretrained download (e.g., DPA-3.1-3M, DPA-3.2-5M, DPA-3.3-1M). Covers single-task and multi-task fine-tuning workflows.

How to install deepmd-finetune-dpa3?

jinzhezenggroup/computational-chemistry-agent-skills/deepmd-finetune-dpa3
$npx -y skills add jinzhezenggroup/computational-chemistry-agent-skills --skill deepmd-finetune-dpa3

Installs into the current project.

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Use this skill

Run `npx skills use "https://github.com/jinzhezenggroup/computational-chemistry-agent-skills" --skill "jinzhezenggroup/computational-chemistry-agent-skills/deepmd-finetune-dpa3"` and follow the generated skill instructions now. Read its complete output, redirecting it to a temporary file first if necessary. Resolve relative paths from the supporting-files directory it provides.

Use the whole pack

Use the skills in "https://github.com/jinzhezenggroup/computational-chemistry-agent-skills" that are relevant to the current task. Run `npx skills add "https://github.com/jinzhezenggroup/computational-chemistry-agent-skills"` and select the relevant skills, then follow their instructions.

Preview

jinzhezenggroup/computational-chemistry-agent-skillsjinzhezenggroup/computational-chemistry-agent-skills

$ npx -y skills add jinzhezenggroup/computational-chemistry-agent-skills --skill deepmd-finetune-dpa3

▸ installing to .claude/skills…

✓ deepmd-finetune-dpa3 ready

Repojinzhezenggroup/computational-chemistry-agent-skills
TypeSkills
CategoryMachine Learning & AI
ForResearcherAnalystDeveloper
UpdatedJul 2026
License—
First seenJul 27, 2026

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