Published July 11, 2023
| Version submitted and accepted - published
Dataset
Open
Structures and data for minimalistic models of cage-like molecules in "Systematic exploration of accessible topologies of cage molecules via minimalistic models"
- 1. Politecnico di Torino
- 2. Imperial College London
Description
Archives of .csv files containing data of lowest energy conformers for all cage configurations tested and associated .mol files.
For paper: Systematic exploration of accessible topologies of cage molecules via minimalistic models with DOI: 10.1039/D3SC03991A
Files
outputdata.zip
Files
(7.9 MB)
| Name | Size | Download all |
|---|---|---|
|
md5:0239ff22217091af288ba6a90d4de67e
|
4.1 MB | Preview Download |
|
md5:bb78a2d4e69b5d42bdae04160244be30
|
3.8 MB | Preview Download |