Published June 19, 2019
| Version v1
Dataset
Open
Dataset for the article "Cost-effective Potential for Accurate Polarizable Embedding Calculations in Protein Environments"
Authors/Creators
- 1. Department of Physics, Chemistry and Pharmacy, University of Southern Denmark
- 2. Hylleraas Centre for Quantum Molecular Sciences, Department of Chemistry, UiT The Arctic University of Norway
- 3. Department of Chemistry and Bioscience, Aalborg University
Description
This dataset contains additional material related to the article: "Cost-effective Potential for Accurate Polarizable Embedding Calculations in Protein Environments". The preprint is available at https://doi.org/10.26434/chemrxiv.8126912. See readme.txt for further description.
Notes
J. M. H. O. acknowledges financial support from the Carlsberg Foundation (Grant ID: CF15-0823) and the Research Council of Norway through its Centres of Excellence scheme (Project ID: 262695). Computational resources were provided by the DeIC National HPC Center at the University of Southern Denmark.