Dataset for the article "Cost-effective Potential for Accurate Polarizable Embedding Calculations in Protein Environments"
Main Authors: | Reinholdt, Peter, Kjellgren, Erik Rosendahl, Steinmann, Casper, Olsen, Jógvan Magnus Haugaard |
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Format: | info dataset Journal |
Terbitan: |
, 2019
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Subjects: | |
Online Access: |
https://zenodo.org/record/3553833 |
Daftar Isi:
- This dataset contains additional material related to the article: "Cost-effective Potential for Accurate Polarizable Embedding Calculations in Protein Environments". Final version of the article is available at https://doi.org/10.1021/acs.jctc.9b00616 (paywall). A preprint is freely available at https://doi.org/10.26434/chemrxiv.8126912. See readme.md for further description.