Define the Molecular Discovery Goal and Initial Plan

Prompt detail, context, and execution controls for real reuse instead of one-off copying.

planningHierarchical Planning Agent for Molecular Discovery with DeepSeek-V3, LangGraph, and Redis VectorPublic prompt

Operator-ready prompt for reuse, tuning, and workspace runs.

This item is set up for developers who want to inspect the original language, fork it into Workspace, and adapt the evidence model without losing the source prompt structure.

Best for

Implementation handoffs, eval setup, and prompt tuning where you need the original structure intact.

Reuse pattern

Inspect first, copy once, then fork into Workspace when you want variants, notes, and model settings attached to the same run.

Before first run

Swap domain facts, examples, and any hard-coded entities for your own context.

Tighten the evidence or verification requirement if this is headed toward production.

Decide which failure mode you want to evaluate first before you branch the prompt.

Operator lens

This prompt already carries implementation detail, tool context, and a final-output instruction. Keep that structure intact when you tune it, or your comparison runs get noisy fast.

Best practice: keep one pristine source version, then branch variants around evaluation criteria, evidence thresholds, and output format.
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Open this prompt inside Workspace when you want a live iteration loop.

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Prompt content

Original prompt text with formatting preserved for inspection and clean copy.

Source prompt
1 active lines
1 sections
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0 checklist items
Raw prompt
Formatting preserved for direct reuse
Define a specific molecular discovery goal, such as finding a new material for organic solar cells with a band gap between 1.5-1.8 eV and high thermal stability. Using DeepSeek-V3, generate a high-level hierarchical plan to achieve this, breaking it down into major phases (e.g., 'Hypothesis Generation', 'Candidate Search', 'Property Prediction', 'Evaluation & Refinement').

Adaptation plan

Keep the source stable, then branch your edits in a predictable order so the next prompt run is easier to evaluate.

Keep stable

Preserve the role framing, objective, and reporting structure so comparison runs stay coherent.

Tune next

Swap in your own domain constraints, anomaly thresholds, and examples before you branch variants.

Verify after

Check whether the prompt asks for the right evidence, confidence signal, and escalation path.

Safe workflow

Copy once for a pristine source snapshot, then move the prompt into Workspace when you want variants, run history, and side-by-side tuning without losing the original.

Prompt diagnostics

Quick signals for how structured this prompt already is and where adaptation work is likely to happen first.

Sections
1
Variables
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Lists
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Reuse posture

This prompt is mostly narrative and instruction-driven, so you can adapt examples and output constraints first without disturbing the structure.

Linked challenge

Hierarchical Planning Agent for Molecular Discovery with DeepSeek-V3, LangGraph, and Redis Vector

This challenge addresses the complex problem of closed-loop molecular discovery by tasking developers to build an intelligent agent capable of hierarchical planning. Inspired by "SCOPE: Language Models as One-Time Teacher for Hierarchical Planning" and "Toward Closed-loop Molecular Discovery," the agent will decompose high-level scientific goals (e.g., "design a molecule with specific properties") into actionable sub-tasks. The system will leverage DeepSeek-V3 as its core reasoning engine, orchestrated by LangGraph for dynamic workflow management and state tracking. A Redis Vector database will serve as a dynamic knowledge graph, integrating molecular data, chemical reactions, and property predictions, enabling RAG-enhanced reasoning and strategic search. ZenML will be used to track experimental outcomes and model iterations, simulating a closed-loop discovery process.

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Use the challenge page to recover the original task boundaries before you tune the prompt. That keeps your variants grounded in the same evaluation target instead of drifting into a different problem.

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