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CovaSyn Chemistry Tools

covair_predict_ir

Predict expected IR absorption bands from SMILES string.

Input Schema

NameRequiredDescriptionDefault
smilesYes
api_keyNo

Output Schema

NameRequiredDescriptionDefault
resultYes

Schema Changelog

Changes observed during successful MCP inspections.

  1. First observed

TDQS

C2.8/5.0
Behavior2/5

Does the description disclose side effects, auth requirements, rate limits, or destructive behavior?

No annotations are provided, so the description carries the full behavioral burden, yet it discloses almost nothing beyond the core action. It does not state whether the api_key is required for the call to succeed, whether predictions are deterministic, or the underlying model's limits; an output schema exists but that only covers return shape, not call behavior.

Agents need to know what a tool does to the world before calling it. Descriptions should go beyond structured annotations to explain consequences.

Conciseness4/5

Is the description appropriately sized, front-loaded, and free of redundancy?

A single front-loaded sentence with no filler, stating the action and input up front. It is efficient, though its brevity contributes to the missing contextual detail rather than being purely a virtue.

Shorter descriptions cost fewer tokens and are easier for agents to parse. Every sentence should earn its place.

Completeness3/5

Given the tool's complexity, does the description cover enough for an agent to succeed on first attempt?

Because an output schema exists, return values need not be explained, which covers part of the completeness burden. However, for a tool with no annotations and a completely undocumented api_key parameter, the description leaves meaningful gaps about authentication and invocation context.

Complex tools with many parameters or behaviors need more documentation. Simple tools need less. This dimension scales expectations accordingly.

Parameters2/5

Does the description clarify parameter syntax, constraints, interactions, or defaults beyond what the schema provides?

Schema description coverage is 0% and there are two parameters. The description only implies the 'smiles' input and says nothing about 'api_key' (its purpose, whether it is needed, or how authentication works), so it fails to compensate for the undocumented schema.

Input schemas describe structure but not intent. Descriptions should explain non-obvious parameter relationships and valid value ranges.

Purpose4/5

Does the description clearly state what the tool does and how it differs from similar tools?

States a specific verb ('predict'), a specific resource ('IR absorption bands'), and the input modality ('SMILES string'), which clearly separates it from identify/annotate/process siblings. It does not explicitly name or contrast with the other prediction-style siblings, but the verb+resource pairing is unambiguous.

Agents choose between tools based on descriptions. A clear purpose with a specific verb and resource helps agents select the right tool.

Usage Guidelines2/5

Does the description explain when to use this tool, when not to, or what alternatives exist?

No guidance on when to use this versus covair_identify, covair_annotate, covair_process, or other covair tools. There is no mention of prerequisites such as needing a valid SMILES or the api_key, and no exclusions or alternatives are given.

Agents often have multiple tools that could apply. Explicit usage guidance like "use X instead of Y when Z" prevents misuse.

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