PockLigGPT: Pocket-Sequence-Conditioned Molecular Generation with GPTs and RL

Pablo Varas Pardo, Guillermo Marcos-Ayuso, Eugenia Ulzurrun, David Ríos Insua, Nuria E. Campillo

Open source

DOI
10.1021/acs.jcim.6c01980
Published
2026-08-17
Container
Journal of Chemical Information and Modeling
Publisher
American Chemical Society (ACS)
Open access
unknown

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BibTeX

@article{allodium:10.1021/acs.jcim.6c01980,
  title = {PockLigGPT: Pocket-Sequence-Conditioned
Molecular
Generation with GPTs and RL},
  author = {Pablo Varas Pardo and Guillermo Marcos-Ayuso and Eugenia Ulzurrun and David Ríos Insua and Nuria E. Campillo},
  year = {2026},
  journal = {Journal of Chemical Information
and Modeling},
  doi = {10.1021/acs.jcim.6c01980},
  url = {https://doi.org/10.1021/acs.jcim.6c01980}
}

RIS

TY  - JOUR
TI  - PockLigGPT: Pocket-Sequence-Conditioned
Molecular
Generation with GPTs and RL
AU  - Pablo Varas Pardo
AU  - Guillermo Marcos-Ayuso
AU  - Eugenia Ulzurrun
AU  - David Ríos Insua
AU  - Nuria E. Campillo
PY  - 2026
JO  - Journal of Chemical Information
and Modeling
DO  - 10.1021/acs.jcim.6c01980
UR  - https://doi.org/10.1021/acs.jcim.6c01980
ER  - 

APA

Pardo, P. V., Marcos-Ayuso, G., Ulzurrun, E., Insua, D. R., & Campillo, N. E. (2026). PockLigGPT: Pocket-Sequence-Conditioned Molecular Generation with GPTs and RL. Journal of Chemical Information and Modeling. https://doi.org/10.1021/acs.jcim.6c01980

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