Mol2Parser is a tool for extracting information from mol2 files. As stated on chemicbook website, mol2 "is a plain text tabular format that represents a single or multiple chemical compounds and holds atomic coordinates, chemical bond information, and metadata of a molecule." For more information check this pdf. Mol2Parser is designed with Python programming language. There are no dependencies or requirements for using Mol2Parser. example.ipynb and 1a1e.mol2 are provided as usage examples.
Milad Rayka, [email protected]
Python=3.8.8
Mol2Parser is tested on the following system:
| OS | RAM | CPU |
|---|---|---|
| Windows 10 | 4.00 GB | Intel Core (TM) i5 - 7200U (2.50 GHz) |
Copyright (c) 2021-2023, Milad Rayka