Mateus-RB / MoleKing

MoleKing is a python module for chemists aiming to add common principles to python. This module adds new types of python variables, MoleKing_Molecule; MoleKing_Atom; MoleKing_SupraMolecule, and MoleKing_Output, alongside many features considered common knowledge among chemists.
MIT License
1 stars 0 forks source link

Pre made molecules #68

Open phfmatias opened 7 months ago

phfmatias commented 7 months ago

It would be pretty cool if we have some Molecules in MoleKing's database. So, we can create pre made molecules like:

Mol = Molecule('H2O')

This can be done by invoking the name, or by smiles.