rowan
CommunityCloud-based quantum chemistry platform
Education & Research#drug discovery#chemistry#computational chemistry#quantum chemistry#molecular modeling#pka prediction
AuthorRowtion
Version1.0.0
Installs0
System Documentation
What problem does it solve?
This Skill provides a cloud-based platform for complex computational chemistry tasks, eliminating the need for local setup and powerful hardware.
Core Features & Use Cases
- Quantum Chemistry Calculations: Perform pKa predictions, geometry optimizations, conformer searches, and more.
- AI-Powered Structure Prediction: Utilize AI models for protein-ligand cofolding.
- Use Case: A researcher needs to predict the pKa of a novel drug candidate. They can use this Skill to submit the molecule's SMILES string and receive the predicted pKa value within minutes, without installing any specialized software.
Quick Start
Use the rowan skill to predict the pKa of the molecule with SMILES 'c1ccccc1O'.
Dependency Matrix
Required Modules
rowan-pythonstjamesrdkit-pypi
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: rowan Download link: https://github.com/Rowtion/Bioclaw/archive/main.zip#rowan 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 223,000+ vetted skills library on demand.