analyze_molecular_complexity
Calculate molecular complexity and synthetic accessibility using PubChem CID for chemical compounds. Ideal for researchers assessing compound feasibility for synthesis.
Instructions
Analyze molecular complexity and synthetic accessibility
Input Schema
TableJSON Schema
| Name | Required | Description | Default |
|---|---|---|---|
| cid | Yes | PubChem Compound ID (CID) |
Implementation Reference
- src/index.ts:1117-1119 (handler)The primary handler function that executes the 'analyze_molecular_complexity' tool logic. Currently implemented as a placeholder indicating the feature is not yet fully developed.
private async handleAnalyzeMolecularComplexity(args: any) { return { content: [{ type: 'text', text: JSON.stringify({ message: 'Molecular complexity analysis not yet implemented', args }, null, 2) }] }; } - src/index.ts:551-561 (schema)Input schema definition for the tool, specifying that a PubChem CID is required. Part of the tools list returned by ListToolsRequestSchema.
{ name: 'analyze_molecular_complexity', description: 'Analyze molecular complexity and synthetic accessibility', inputSchema: { type: 'object', properties: { cid: { type: ['number', 'string'], description: 'PubChem Compound ID (CID)' }, }, required: ['cid'], }, }, - src/index.ts:774-775 (registration)Dispatch registration in the CallToolRequestSchema handler's switch statement, routing tool calls to the appropriate handler method.
case 'analyze_molecular_complexity': return await this.handleAnalyzeMolecularComplexity(args);