---
_id: '6921'
article_type: original
author:
- first_name: Parastoo
  full_name: Semnani, Parastoo
  last_name: Semnani
- first_name: Mihail
  full_name: Bogojeski, Mihail
  last_name: Bogojeski
- first_name: Florian
  full_name: Bley, Florian
  last_name: Bley
- first_name: Zizheng
  full_name: Zhang, Zizheng
  last_name: Zhang
- first_name: Qiong
  full_name: Wu, Qiong
  last_name: Wu
- first_name: Thomas
  full_name: Kneib, Thomas
  last_name: Kneib
- first_name: Jan
  full_name: Herrmann, Jan
  last_name: Herrmann
- first_name: Christoph
  full_name: Weisser, Christoph
  id: '264138'
  last_name: Weisser
- first_name: Florina
  full_name: Patcas, Florina
  last_name: Patcas
- first_name: Klaus-Robert
  full_name: Müller, Klaus-Robert
  last_name: Müller
citation:
  alphadin: '<span style="font-variant:small-caps;"><span style="font-variant:small-caps;">Semnani,
    Parastoo</span> ; <span style="font-variant:small-caps;">Bogojeski, Mihail</span>
    ; <span style="font-variant:small-caps;">Bley, Florian</span> ; <span style="font-variant:small-caps;">Zhang,
    Zizheng</span> ; <span style="font-variant:small-caps;">Wu, Qiong</span> ; <span
    style="font-variant:small-caps;">Kneib, Thomas</span> ; <span style="font-variant:small-caps;">Herrmann,
    Jan</span> ; <span style="font-variant:small-caps;">Weisser, Christoph</span>
    ; u. a.</span>: A Machine Learning and Explainable AI Framework Tailored for Unbalanced
    Experimental Catalyst Discovery. In: <i>Journal of Physical Chemistry C</i> Bd.
    128 (2024), Nr. 50, S. 21349–21367'
  ama: Semnani P, Bogojeski M, Bley F, et al. A Machine Learning and Explainable AI
    Framework Tailored for Unbalanced Experimental Catalyst Discovery. <i>Journal
    of Physical Chemistry C</i>. 2024;128(50):21349-21367. doi:<a href="https://doi.org/10.1021/acs.jpcc.4c05332">10.1021/acs.jpcc.4c05332</a>
  apa: Semnani, P., Bogojeski, M., Bley, F., Zhang, Z., Wu, Q., Kneib, T., … Müller,
    K.-R. (2024). A Machine Learning and Explainable AI Framework Tailored for Unbalanced
    Experimental Catalyst Discovery. <i>Journal of Physical Chemistry C</i>, <i>128</i>(50),
    21349–21367. <a href="https://doi.org/10.1021/acs.jpcc.4c05332">https://doi.org/10.1021/acs.jpcc.4c05332</a>
  bibtex: '@article{Semnani_Bogojeski_Bley_Zhang_Wu_Kneib_Herrmann_Weisser_Patcas_Müller_2024,
    title={A Machine Learning and Explainable AI Framework Tailored for Unbalanced
    Experimental Catalyst Discovery}, volume={128}, DOI={<a href="https://doi.org/10.1021/acs.jpcc.4c05332">10.1021/acs.jpcc.4c05332</a>},
    number={50}, journal={Journal of Physical Chemistry C}, author={Semnani, Parastoo
    and Bogojeski, Mihail and Bley, Florian and Zhang, Zizheng and Wu, Qiong and Kneib,
    Thomas and Herrmann, Jan and Weisser, Christoph and Patcas, Florina and Müller,
    Klaus-Robert}, year={2024}, pages={21349–21367} }'
  chicago: 'Semnani, Parastoo, Mihail Bogojeski, Florian Bley, Zizheng Zhang, Qiong
    Wu, Thomas Kneib, Jan Herrmann, Christoph Weisser, Florina Patcas, and Klaus-Robert
    Müller. “A Machine Learning and Explainable AI Framework Tailored for Unbalanced
    Experimental Catalyst Discovery.” <i>Journal of Physical Chemistry C</i> 128,
    no. 50 (2024): 21349–67. <a href="https://doi.org/10.1021/acs.jpcc.4c05332">https://doi.org/10.1021/acs.jpcc.4c05332</a>.'
  ieee: P. Semnani <i>et al.</i>, “A Machine Learning and Explainable AI Framework
    Tailored for Unbalanced Experimental Catalyst Discovery,” <i>Journal of Physical
    Chemistry C</i>, vol. 128, no. 50, pp. 21349–21367, 2024.
  mla: Semnani, Parastoo, et al. “A Machine Learning and Explainable AI Framework
    Tailored for Unbalanced Experimental Catalyst Discovery.” <i>Journal of Physical
    Chemistry C</i>, vol. 128, no. 50, 2024, pp. 21349–67, doi:<a href="https://doi.org/10.1021/acs.jpcc.4c05332">10.1021/acs.jpcc.4c05332</a>.
  short: P. Semnani, M. Bogojeski, F. Bley, Z. Zhang, Q. Wu, T. Kneib, J. Herrmann,
    C. Weisser, F. Patcas, K.-R. Müller, Journal of Physical Chemistry C 128 (2024)
    21349–21367.
date_created: 2026-05-28T11:16:13Z
date_updated: 2026-05-29T07:23:09Z
doi: 10.1021/acs.jpcc.4c05332
intvolume: '       128'
issue: '50'
language:
- iso: eng
main_file_link:
- open_access: '1'
oa: '1'
page: 21349-21367
publication: Journal of Physical Chemistry C
publication_identifier:
  eissn:
  - 1932-7455
  issn:
  - 1932-7447
publication_status: published
quality_controlled: '1'
status: public
title: A Machine Learning and Explainable AI Framework Tailored for Unbalanced Experimental
  Catalyst Discovery
type: journal_article
user_id: '220548'
volume: 128
year: '2024'
...