Neural Network Corrections to Intermolecular Interaction Terms of a Molecular Force Field Capture Nuclear Quantum Effects in Calculations of Liquid Thermodynamic Properties.
- DOI
- 10.1021/acs.jctc.3c00921
- Published
- 2024 Feb 13
- Container
- Journal of chemical theory and computation
- Publisher
- Not recorded
- Open access
- yes
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Cite this work
BibTeX
@article{allodium:10.1021/acs.jctc.3c00921,
title = {Neural Network Corrections to Intermolecular Interaction Terms of a Molecular Force Field Capture Nuclear Quantum Effects in Calculations of Liquid Thermodynamic Properties.},
author = {Kurnikov IV and Pereyaslavets L and Kamath G and Sakipov SN and Voronina E and Butin O and Illarionov A and Leontyev I and Nawrocki G and Darkhovskiy M and Olevanov M and Ivahnenko I and Chen Y and Lock CB and Levitt M and Kornberg RD and Fain B},
year = {2024},
journal = {Journal of chemical theory and computation},
doi = {10.1021/acs.jctc.3c00921},
url = {https://doi.org/10.1021/acs.jctc.3c00921}
}RIS
TY - JOUR TI - Neural Network Corrections to Intermolecular Interaction Terms of a Molecular Force Field Capture Nuclear Quantum Effects in Calculations of Liquid Thermodynamic Properties. AU - Kurnikov IV AU - Pereyaslavets L AU - Kamath G AU - Sakipov SN AU - Voronina E AU - Butin O AU - Illarionov A AU - Leontyev I AU - Nawrocki G AU - Darkhovskiy M AU - Olevanov M AU - Ivahnenko I AU - Chen Y AU - Lock CB AU - Levitt M AU - Kornberg RD AU - Fain B PY - 2024 JO - Journal of chemical theory and computation DO - 10.1021/acs.jctc.3c00921 UR - https://doi.org/10.1021/acs.jctc.3c00921 ER -
APA
IV, K., L, P., G, K., SN, S., E, V., O, B., A, I., I, L., G, N., M, D., M, O., I, I., Y, C., CB, L., M, L., RD, K., & B, F. (2024). Neural Network Corrections to Intermolecular Interaction Terms of a Molecular Force Field Capture Nuclear Quantum Effects in Calculations of Liquid Thermodynamic Properties.. Journal of chemical theory and computation. https://doi.org/10.1021/acs.jctc.3c00921
Source records
- pubmed · retrieved 2026-09-25T10:47:33.820Z