PWTK 3.2 -- Scripting Interface for Quantum ESPRESSO

5.6. Structural UtilitiesSections

TABLE OF CONTENTS

• smiles
• ::pwtk::smi2coor
• ::pwtk::smi2png
• ::pwtk::smi2svg
• ::pwtk::smi2xsf
• ::pwtk::smilesToCoor

---

smiles

DESCRIPTION

A collection of routines associated with SMILES, https://en.wikipedia.org/wiki/Simplified_molecular-input_line-entry_system

Generated from ./src/smiles.tcl with ROBODoc V4.99.45 on 2024-11-11 13:53:59