SAMTI: Sampling Adaptive Thermodynamic Integration for Alchemical Free Energy Calculations

Tai-Sung Lee, Omid Jahanmahin, Saikat Pal, Darrin M. York

Open source

DOI: 10.1021/acs.jpcb.5c05358
Published: 2025-12-09
Container: The Journal of Physical Chemistry B
Publisher: American Chemical Society (ACS)
Open access: unknown

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Cite this work

BibTeX

@article{allodium:10.1021/acs.jpcb.5c05358,
  title = {SAMTI: Sampling Adaptive Thermodynamic Integration for Alchemical Free Energy Calculations},
  author = {Tai-Sung Lee and Omid Jahanmahin and Saikat Pal and Darrin M. York},
  year = {2025},
  journal = {The Journal of Physical Chemistry B},
  doi = {10.1021/acs.jpcb.5c05358},
  url = {https://doi.org/10.1021/acs.jpcb.5c05358}
}

RIS

TY  - JOUR
TI  - SAMTI: Sampling Adaptive Thermodynamic Integration for Alchemical Free Energy Calculations
AU  - Tai-Sung Lee
AU  - Omid Jahanmahin
AU  - Saikat Pal
AU  - Darrin M. York
PY  - 2025
JO  - The Journal of Physical Chemistry B
DO  - 10.1021/acs.jpcb.5c05358
UR  - https://doi.org/10.1021/acs.jpcb.5c05358
ER  -

APA

Lee, T., Jahanmahin, O., Pal, S., & York, D. M. (2025). SAMTI: Sampling Adaptive Thermodynamic Integration for Alchemical Free Energy Calculations. The Journal of Physical Chemistry B. https://doi.org/10.1021/acs.jpcb.5c05358

Source records

crossref · retrieved 2026-09-27T02:33:07.288Z