Commit History
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Sync CpptrajAI: updated code, README, agent flow diagram
Verified signatured9ad05e
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Deploy CpptrajGPT to HuggingFace Spaces
hemantn +1: Claude Sonnet 4.6- Flask + multi-user session isolation (per-session runner/agent/state) - AI agent: Claude, OpenAI (Responses API), Gemini (native SDK) - cpptraj editor, Python editor, 3D trajectory viewer - RAG over cpptraj manual (pre-built cache JSON) - Dockerfile: conda-forge cpptraj, port 7860, non-root user Co-Authored-By: Claude Sonnet 4.6 <noreply@anthropic.com>037ba33