FidhaNazreen/MDSimulationAgent

Installable Python CLI that drives a full GROMACS MD workflow end-to-end from a natural-language prompt via Claude Code — 13-step DAG, per-step fingerprinting, resume-after-crash, 3 Claude skills, 8 tutorials, 148+ tests.

O que é MDSimulationAgent?

MDSimulationAgent is a Claude Code agent skill that installable Python CLI that drives a full GROMACS MD workflow end-to-end from a natural-language prompt via Claude Code — 13-step DAG, per-step fingerprinting, resume-after-crash, 3 Claude skills, 8 tutorials, 148+ tests.

Funciona comClaude Code~Codex CLI~Cursor
npx skills add FidhaNazreen/MDSimulationAgent

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Documentação

O que MDSimulationAgent faz?

Installable Python CLI that drives a full GROMACS MD workflow end-to-end from a natural-language prompt via Claude Code — 13-step DAG, per-step fingerprinting, resume-after-crash, 3 Claude skills, 8 tutorials, 148+ tests.

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