Welcome to TABS!

TABS stands for Torsion Angular Bin Strings and is a discrete vector representation of a conformer’s torsional angles. Through this discretization, conformational states can be counted, yielding in an estimate of the upper limit of the expected conformational ensemble size (nTABS).

Get started by installing the TABS package and learn how to use it.

Getting Started

• Introduction
  • What is TABS?
  • Installation Guide
  • Basic Usage
• Basic Functionality Reference
  • Core Class
    • DihedralsInfo
    • DihedralInfoFromTorsionLib()
  • Core Class Methods
    • DihedralsInfo.GetTABS()
    • DihedralsInfo.GetnTABS()
    • DihedralsInfo.GetConformerTorsions()

Standard TABS Methodology

• Standard TABS Methodology

Frequently Asked Questions

• FAQs