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solitarius

REINVENT4 de novo molecular design, exposed to coding agents as validated MCP tools.

0 · lcmd-epfl/Solitarius-mcp1 pluginApache-2.0updated 3 months ago

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solitarius-mcp

claude

REINVENT4 molecular design as MCP tools — sampling, transfer learning, and staged RL with interactive scoring-function design — plus skills for validation, job status, analysis, and custom scoring components. Requires a locally built GPU Docker container (see README).

7 skills · 1 MCP server

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