MBX V1.2: Accelerating Data-Driven Many-Body Molecular Dynamics Simulations.

Gupta S, Bull-Vulpe EF, Agnew H, Iyer S, Zhu X, Zhou R, Knight C, Paesani F

DOI: 10.1021/acs.jctc.4c01333
Published: 2025 Feb 25
Container: Journal of chemical theory and computation
Publisher: Not recorded
Open access: no

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Cite this work

BibTeX

@article{allodium:10.1021/acs.jctc.4c01333,
  title = {MBX V1.2: Accelerating Data-Driven Many-Body Molecular Dynamics Simulations.},
  author = {Gupta S and Bull-Vulpe EF and Agnew H and Iyer S and Zhu X and Zhou R and Knight C and Paesani F},
  year = {2025},
  journal = {Journal of chemical theory and computation},
  doi = {10.1021/acs.jctc.4c01333},
  url = {https://doi.org/10.1021/acs.jctc.4c01333}
}

RIS

TY  - JOUR
TI  - MBX V1.2: Accelerating Data-Driven Many-Body Molecular Dynamics Simulations.
AU  - Gupta S
AU  - Bull-Vulpe EF
AU  - Agnew H
AU  - Iyer S
AU  - Zhu X
AU  - Zhou R
AU  - Knight C
AU  - Paesani F
PY  - 2025
JO  - Journal of chemical theory and computation
DO  - 10.1021/acs.jctc.4c01333
UR  - https://doi.org/10.1021/acs.jctc.4c01333
ER  -

APA

S, G., EF, B., H, A., S, I., X, Z., R, Z., C, K., & F, P. (2025). MBX V1.2: Accelerating Data-Driven Many-Body Molecular Dynamics Simulations.. Journal of chemical theory and computation. https://doi.org/10.1021/acs.jctc.4c01333

Source records

pubmed · retrieved 2026-09-27T01:12:50.299Z
europe-pmc · retrieved 2026-09-27T01:12:50.310Z