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.

Compatible avecClaude Code~Codex CLI~Cursor
npx add-skill FidhaNazreen/MDSimulationAgent

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.

Skills associés