The answer
io.github.adacapo21/openmm-mcp
Top verified match: it matches your intent, corroborated across multiple registries.
fresh · published 177d ago · verified 2026-08-08tested · static-verifiedsigned passport ✓score 41/100
claude mcp add openmm-mcp -- npx -y @qbtlabs/openmm-mcp