adme-property-predictor
CommunityPredict ADME to guide drug lead optimization.
Data & Analytics#cheminformatics#batch-processing#predictions#drug-design#adme#qsar#pharmacokinetics
Authorjakechen1
Version1.0.0
Installs0
System Documentation
What problem does it solve?
ADME property prediction enables rapid evaluation of drug-like behavior for candidate molecules, reducing unnecessary experimental screening and guiding choice of which compounds to advance.
Core Features & Use Cases
- Multi-Property Prediction: Absorption, Distribution, Metabolism, Excretion
- Drug-Likeness Scoring: Lipinski compliance, PSA and other metrics
- Batch Processing: Analyze libraries of molecules efficiently
- Integrated Scoring: Combines ADME data into an overall drug-likeness score
- Use Case: Prioritize compounds for synthesis with PK-friendly profiles
Quick Start
Provide a SMILES string to run a complete ADME prediction and receive a structured result.
Dependency Matrix
Required Modules
rdkitdataclasses
Components
scriptsreferences
💻 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: adme-property-predictor Download link: https://github.com/jakechen1/echo-research-framework/archive/main.zip#adme-property-predictor Please download this .zip file, extract it, and install it in the .claude/skills/ directory.
Agent Skills Search Helper
Install a tiny helper to your Agent, search and equip skill from 471,000+ vetted skills library on demand.