cheminformatics

Community

Assess chemistry ML claims with rigorous critique

AuthorAvaivartika
Version1.0.0
Installs0

System Documentation

What problem does it solve?

Review and critique chemistry manuscripts that claim advances in molecular ML, QSAR, docking, retrosynthesis, reaction prediction, molecular generation, and related manuscript claims, ensuring rigor and transparency.

Core Features & Use Cases

  • Review Focus: evaluate molecule split strategies (random, scaffold, temporal, cluster), descriptor/fingerprint/model reporting, and leakage risks.
  • Validation checks: assess docking/screening targets, protonation states, controls, scoring limitations; assess generation claims for validity, uniqueness, diversity, and synthesizability; ensure claims are supported with data and methodology.
  • Output: separate methodological risks from wording risks; provide precise revision suggestions for claims, methods, and limitations.

Quick Start

Review the attached chemistry manuscript and provide precise revisions for molecular ML, docking, and generation claims.

Dependency Matrix

Required Modules

None required

Components

Standard package

💻 Claude Code Installation

Recommended: Let Claude install automatically. Simply copy and paste the text below to Claude Code.

Please help me install this Skill:
Name: cheminformatics
Download link: https://github.com/Avaivartika/jiaoleaf-ai/archive/main.zip#cheminformatics

Please download this .zip file, extract it, and install it in the .claude/skills/ directory.
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