Accurate determination of solvation free energies of neutral organic compounds from first principles.
- DOI
- 10.1038/s41467-022-28041-0
- Published
- 2022 Jan 20
- Container
- Nature communications
- Publisher
- Not recorded
- Open access
- yes
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Cite this work
BibTeX
@article{allodium:10.1038/s41467-022-28041-0,
title = {Accurate determination of solvation free energies of neutral organic compounds from first principles.},
author = {Pereyaslavets L and Kamath G and Butin O and Illarionov A and Olevanov M and Kurnikov I and Sakipov S and Leontyev I and Voronina E and Gannon T and Nawrocki G and Darkhovskiy M and Ivahnenko I and Kostikov A and Scaranto J and Kurnikova MG and Banik S and Chan H and Sternberg MG and Sankaranarayanan SKRS and Crawford B and Potoff J and Levitt M and Kornberg RD and Fain B},
year = {2022},
journal = {Nature communications},
doi = {10.1038/s41467-022-28041-0},
url = {https://doi.org/10.1038/s41467-022-28041-0}
}RIS
TY - JOUR TI - Accurate determination of solvation free energies of neutral organic compounds from first principles. AU - Pereyaslavets L AU - Kamath G AU - Butin O AU - Illarionov A AU - Olevanov M AU - Kurnikov I AU - Sakipov S AU - Leontyev I AU - Voronina E AU - Gannon T AU - Nawrocki G AU - Darkhovskiy M AU - Ivahnenko I AU - Kostikov A AU - Scaranto J AU - Kurnikova MG AU - Banik S AU - Chan H AU - Sternberg MG AU - Sankaranarayanan SKRS AU - Crawford B AU - Potoff J AU - Levitt M AU - Kornberg RD AU - Fain B PY - 2022 JO - Nature communications DO - 10.1038/s41467-022-28041-0 UR - https://doi.org/10.1038/s41467-022-28041-0 ER -
APA
L, P., G, K., O, B., A, I., M, O., I, K., S, S., I, L., E, V., T, G., G, N., M, D., I, I., A, K., J, S., MG, K., S, B., H, C., MG, S., SKRS, S., B, C., J, P., M, L., RD, K., & B, F. (2022). Accurate determination of solvation free energies of neutral organic compounds from first principles.. Nature communications. https://doi.org/10.1038/s41467-022-28041-0
Source records
- pubmed · retrieved 2026-09-26T01:08:38.736Z