---
_id: '64873'
abstract:
- lang: eng
  text: Continuous flow catalysis utilizing gel-bound organocatalysts within a microfluidic
    reactor represents a compelling strategy in the realm of organic synthesis. In
    this study, a quinuclidine-based catalytic monomer (QMA) was synthesized to create
    polymer gel dots through the process of photopolymerization that serve as a support
    for the catalyst. The resulting gel-bound organocatalysts were assembled within
    a continuous microfluidic reactor to facilitate the Baylis–Hillman reaction between
    various aldehydes and acrylonitrile at a temperature of 50 °C. The conversion
    of the product was assessed using 1H NMR spectroscopy as an offline analytical
    method over a duration of 8 h. The findings indicated that highly reactive aldehydes
    achieved conversion rates exceeding 90%, in contrast to their less reactive counterparts.
    Furthermore, these results were juxtaposed with previously published data derived
    from alternative synthetic methodologies, revealing that the continuous microfluidic
    reactions employing integrated organocatalysts within polymer networks exhibited
    significantly higher conversions with reduced reaction times (8 h) at the same
    temperature (50 °C). Additionally, the influence of different geometries (round,
    triangular, and square) of the gel dots on catalytic activity was investigated,
    with round and square gel dots demonstrating slightly superior performance compared
    with triangular gel dots, attributed to their increased surface area. Moreover,
    an extended reaction period of 6 days was conducted using 4-bromobenzaldehyde
    and acrylonitrile, resulting in a conversion rate exceeding 70%, which remained
    stable for 5 days before experiencing a slight decline due to product accumulation
    on the gel dots.
article_number: '14448'
article_type: original
author:
- first_name: Naresh
  full_name: Killi, Naresh
  last_name: Killi
- first_name: Amit
  full_name: Kumar, Amit
  last_name: Kumar
- first_name: Leena
  full_name: Nebhani, Leena
  last_name: Nebhani
- first_name: Franziska
  full_name: Obst, Franziska
  last_name: Obst
- first_name: Andreas
  full_name: Richter, Andreas
  last_name: Richter
- first_name: Bernhard
  full_name: Reineke Matsudo, Bernhard
  last_name: Reineke Matsudo
- first_name: Thomas
  full_name: Zentgraf, Thomas
  id: '30525'
  last_name: Zentgraf
  orcid: 0000-0002-8662-1101
- first_name: Dirk
  full_name: Kuckling, Dirk
  id: '287'
  last_name: Kuckling
citation:
  ama: Killi N, Kumar A, Nebhani L, et al. Integrating an Organocatalyst into a Polymeric
    Gel Framework for the Continuous Microflow Baylis–Hillman Reaction. <i>ACS Omega</i>.
    2026;11(9). doi:<a href="https://doi.org/10.1021/acsomega.5c09476">10.1021/acsomega.5c09476</a>
  apa: Killi, N., Kumar, A., Nebhani, L., Obst, F., Richter, A., Reineke Matsudo,
    B., Zentgraf, T., &#38; Kuckling, D. (2026). Integrating an Organocatalyst into
    a Polymeric Gel Framework for the Continuous Microflow Baylis–Hillman Reaction.
    <i>ACS Omega</i>, <i>11</i>(9), Article 14448. <a href="https://doi.org/10.1021/acsomega.5c09476">https://doi.org/10.1021/acsomega.5c09476</a>
  bibtex: '@article{Killi_Kumar_Nebhani_Obst_Richter_Reineke Matsudo_Zentgraf_Kuckling_2026,
    title={Integrating an Organocatalyst into a Polymeric Gel Framework for the Continuous
    Microflow Baylis–Hillman Reaction}, volume={11}, DOI={<a href="https://doi.org/10.1021/acsomega.5c09476">10.1021/acsomega.5c09476</a>},
    number={914448}, journal={ACS Omega}, publisher={American Chemical Society (ACS)},
    author={Killi, Naresh and Kumar, Amit and Nebhani, Leena and Obst, Franziska and
    Richter, Andreas and Reineke Matsudo, Bernhard and Zentgraf, Thomas and Kuckling,
    Dirk}, year={2026} }'
  chicago: Killi, Naresh, Amit Kumar, Leena Nebhani, Franziska Obst, Andreas Richter,
    Bernhard Reineke Matsudo, Thomas Zentgraf, and Dirk Kuckling. “Integrating an
    Organocatalyst into a Polymeric Gel Framework for the Continuous Microflow Baylis–Hillman
    Reaction.” <i>ACS Omega</i> 11, no. 9 (2026). <a href="https://doi.org/10.1021/acsomega.5c09476">https://doi.org/10.1021/acsomega.5c09476</a>.
  ieee: 'N. Killi <i>et al.</i>, “Integrating an Organocatalyst into a Polymeric Gel
    Framework for the Continuous Microflow Baylis–Hillman Reaction,” <i>ACS Omega</i>,
    vol. 11, no. 9, Art. no. 14448, 2026, doi: <a href="https://doi.org/10.1021/acsomega.5c09476">10.1021/acsomega.5c09476</a>.'
  mla: Killi, Naresh, et al. “Integrating an Organocatalyst into a Polymeric Gel Framework
    for the Continuous Microflow Baylis–Hillman Reaction.” <i>ACS Omega</i>, vol.
    11, no. 9, 14448, American Chemical Society (ACS), 2026, doi:<a href="https://doi.org/10.1021/acsomega.5c09476">10.1021/acsomega.5c09476</a>.
  short: N. Killi, A. Kumar, L. Nebhani, F. Obst, A. Richter, B. Reineke Matsudo,
    T. Zentgraf, D. Kuckling, ACS Omega 11 (2026).
date_created: 2026-03-10T08:23:43Z
date_updated: 2026-03-10T08:27:15Z
department:
- _id: '15'
- _id: '230'
- _id: '289'
- _id: '623'
- _id: '2'
- _id: '311'
doi: 10.1021/acsomega.5c09476
intvolume: '        11'
issue: '9'
language:
- iso: eng
main_file_link:
- open_access: '1'
  url: https://pubs.acs.org/doi/abs/10.1021/acsomega.5c09476
oa: '1'
publication: ACS Omega
publication_identifier:
  issn:
  - 2470-1343
  - 2470-1343
publication_status: published
publisher: American Chemical Society (ACS)
quality_controlled: '1'
status: public
title: Integrating an Organocatalyst into a Polymeric Gel Framework for the Continuous
  Microflow Baylis–Hillman Reaction
type: journal_article
user_id: '30525'
volume: 11
year: '2026'
...
---
_id: '40563'
author:
- first_name: Mária
  full_name: Jerigová, Mária
  last_name: Jerigová
- first_name: Mateusz
  full_name: Odziomek, Mateusz
  last_name: Odziomek
- first_name: Nieves
  full_name: Lopez Salas, Nieves
  id: '98120'
  last_name: Lopez Salas
  orcid: https://orcid.org/0000-0002-8438-9548
citation:
  ama: Jerigová M, Odziomek M, Lopez Salas N. “We Are Here!” Oxygen Functional Groups
    in Carbons for Electrochemical Applications. <i>ACS Omega</i>. 2022;7(14):11544-11554.
    doi:<a href="https://doi.org/10.1021/acsomega.2c00639">10.1021/acsomega.2c00639</a>
  apa: Jerigová, M., Odziomek, M., &#38; Lopez Salas, N. (2022). “We Are Here!” Oxygen
    Functional Groups in Carbons for Electrochemical Applications. <i>ACS Omega</i>,
    <i>7</i>(14), 11544–11554. <a href="https://doi.org/10.1021/acsomega.2c00639">https://doi.org/10.1021/acsomega.2c00639</a>
  bibtex: '@article{Jerigová_Odziomek_Lopez Salas_2022, title={“We Are Here!” Oxygen
    Functional Groups in Carbons for Electrochemical Applications}, volume={7}, DOI={<a
    href="https://doi.org/10.1021/acsomega.2c00639">10.1021/acsomega.2c00639</a>},
    number={14}, journal={ACS Omega}, publisher={American Chemical Society (ACS)},
    author={Jerigová, Mária and Odziomek, Mateusz and Lopez Salas, Nieves}, year={2022},
    pages={11544–11554} }'
  chicago: 'Jerigová, Mária, Mateusz Odziomek, and Nieves Lopez Salas. “‘We Are Here!’
    Oxygen Functional Groups in Carbons for Electrochemical Applications.” <i>ACS
    Omega</i> 7, no. 14 (2022): 11544–54. <a href="https://doi.org/10.1021/acsomega.2c00639">https://doi.org/10.1021/acsomega.2c00639</a>.'
  ieee: 'M. Jerigová, M. Odziomek, and N. Lopez Salas, “‘We Are Here!’ Oxygen Functional
    Groups in Carbons for Electrochemical Applications,” <i>ACS Omega</i>, vol. 7,
    no. 14, pp. 11544–11554, 2022, doi: <a href="https://doi.org/10.1021/acsomega.2c00639">10.1021/acsomega.2c00639</a>.'
  mla: Jerigová, Mária, et al. “‘We Are Here!’ Oxygen Functional Groups in Carbons
    for Electrochemical Applications.” <i>ACS Omega</i>, vol. 7, no. 14, American
    Chemical Society (ACS), 2022, pp. 11544–54, doi:<a href="https://doi.org/10.1021/acsomega.2c00639">10.1021/acsomega.2c00639</a>.
  short: M. Jerigová, M. Odziomek, N. Lopez Salas, ACS Omega 7 (2022) 11544–11554.
date_created: 2023-01-27T16:19:39Z
date_updated: 2023-01-27T16:35:38Z
doi: 10.1021/acsomega.2c00639
intvolume: '         7'
issue: '14'
keyword:
- General Chemical Engineering
- General Chemistry
language:
- iso: eng
page: 11544-11554
publication: ACS Omega
publication_identifier:
  issn:
  - 2470-1343
  - 2470-1343
publication_status: published
publisher: American Chemical Society (ACS)
status: public
title: “We Are Here!” Oxygen Functional Groups in Carbons for Electrochemical Applications
type: journal_article
user_id: '98120'
volume: 7
year: '2022'
...
---
_id: '37710'
author:
- first_name: Isaac Azahel
  full_name: Ruiz Alvarado, Isaac Azahel
  id: '79462'
  last_name: Ruiz Alvarado
  orcid: 0000-0002-4710-1170
- first_name: Wolf Gero
  full_name: Schmidt, Wolf Gero
  id: '468'
  last_name: Schmidt
  orcid: 0000-0002-2717-5076
citation:
  ama: Ruiz Alvarado IA, Schmidt WG. Water/InP(001) from Density Functional Theory.
    <i>ACS Omega</i>. 2022;7(23):19355-19364. doi:<a href="https://doi.org/10.1021/acsomega.2c00948">10.1021/acsomega.2c00948</a>
  apa: Ruiz Alvarado, I. A., &#38; Schmidt, W. G. (2022). Water/InP(001) from Density
    Functional Theory. <i>ACS Omega</i>, <i>7</i>(23), 19355–19364. <a href="https://doi.org/10.1021/acsomega.2c00948">https://doi.org/10.1021/acsomega.2c00948</a>
  bibtex: '@article{Ruiz Alvarado_Schmidt_2022, title={Water/InP(001) from Density
    Functional Theory}, volume={7}, DOI={<a href="https://doi.org/10.1021/acsomega.2c00948">10.1021/acsomega.2c00948</a>},
    number={23}, journal={ACS Omega}, publisher={American Chemical Society (ACS)},
    author={Ruiz Alvarado, Isaac Azahel and Schmidt, Wolf Gero}, year={2022}, pages={19355–19364}
    }'
  chicago: 'Ruiz Alvarado, Isaac Azahel, and Wolf Gero Schmidt. “Water/InP(001) from
    Density Functional Theory.” <i>ACS Omega</i> 7, no. 23 (2022): 19355–64. <a href="https://doi.org/10.1021/acsomega.2c00948">https://doi.org/10.1021/acsomega.2c00948</a>.'
  ieee: 'I. A. Ruiz Alvarado and W. G. Schmidt, “Water/InP(001) from Density Functional
    Theory,” <i>ACS Omega</i>, vol. 7, no. 23, pp. 19355–19364, 2022, doi: <a href="https://doi.org/10.1021/acsomega.2c00948">10.1021/acsomega.2c00948</a>.'
  mla: Ruiz Alvarado, Isaac Azahel, and Wolf Gero Schmidt. “Water/InP(001) from Density
    Functional Theory.” <i>ACS Omega</i>, vol. 7, no. 23, American Chemical Society
    (ACS), 2022, pp. 19355–64, doi:<a href="https://doi.org/10.1021/acsomega.2c00948">10.1021/acsomega.2c00948</a>.
  short: I.A. Ruiz Alvarado, W.G. Schmidt, ACS Omega 7 (2022) 19355–19364.
date_created: 2023-01-20T11:16:22Z
date_updated: 2023-04-20T13:59:34Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '230'
- _id: '35'
doi: 10.1021/acsomega.2c00948
intvolume: '         7'
issue: '23'
keyword:
- General Chemical Engineering
- General Chemistry
language:
- iso: eng
page: 19355-19364
project:
- _id: '52'
  name: 'PC2: Computing Resources Provided by the Paderborn Center for Parallel Computing'
publication: ACS Omega
publication_identifier:
  issn:
  - 2470-1343
  - 2470-1343
publication_status: published
publisher: American Chemical Society (ACS)
status: public
title: Water/InP(001) from Density Functional Theory
type: journal_article
user_id: '16199'
volume: 7
year: '2022'
...
---
_id: '37714'
author:
- first_name: Marsel
  full_name: Karmo, Marsel
  last_name: Karmo
- first_name: Isaac Azahel
  full_name: Ruiz Alvarado, Isaac Azahel
  id: '79462'
  last_name: Ruiz Alvarado
  orcid: 0000-0002-4710-1170
- first_name: Wolf Gero
  full_name: Schmidt, Wolf Gero
  id: '468'
  last_name: Schmidt
  orcid: 0000-0002-2717-5076
- first_name: Erich
  full_name: Runge, Erich
  last_name: Runge
citation:
  ama: Karmo M, Ruiz Alvarado IA, Schmidt WG, Runge E. Reconstructions of the As-Terminated
    GaAs(001) Surface Exposed to Atomic Hydrogen. <i>ACS Omega</i>. 2022;7(6):5064-5068.
    doi:<a href="https://doi.org/10.1021/acsomega.1c06019">10.1021/acsomega.1c06019</a>
  apa: Karmo, M., Ruiz Alvarado, I. A., Schmidt, W. G., &#38; Runge, E. (2022). Reconstructions
    of the As-Terminated GaAs(001) Surface Exposed to Atomic Hydrogen. <i>ACS Omega</i>,
    <i>7</i>(6), 5064–5068. <a href="https://doi.org/10.1021/acsomega.1c06019">https://doi.org/10.1021/acsomega.1c06019</a>
  bibtex: '@article{Karmo_Ruiz Alvarado_Schmidt_Runge_2022, title={Reconstructions
    of the As-Terminated GaAs(001) Surface Exposed to Atomic Hydrogen}, volume={7},
    DOI={<a href="https://doi.org/10.1021/acsomega.1c06019">10.1021/acsomega.1c06019</a>},
    number={6}, journal={ACS Omega}, publisher={American Chemical Society (ACS)},
    author={Karmo, Marsel and Ruiz Alvarado, Isaac Azahel and Schmidt, Wolf Gero and
    Runge, Erich}, year={2022}, pages={5064–5068} }'
  chicago: 'Karmo, Marsel, Isaac Azahel Ruiz Alvarado, Wolf Gero Schmidt, and Erich
    Runge. “Reconstructions of the As-Terminated GaAs(001) Surface Exposed to Atomic
    Hydrogen.” <i>ACS Omega</i> 7, no. 6 (2022): 5064–68. <a href="https://doi.org/10.1021/acsomega.1c06019">https://doi.org/10.1021/acsomega.1c06019</a>.'
  ieee: 'M. Karmo, I. A. Ruiz Alvarado, W. G. Schmidt, and E. Runge, “Reconstructions
    of the As-Terminated GaAs(001) Surface Exposed to Atomic Hydrogen,” <i>ACS Omega</i>,
    vol. 7, no. 6, pp. 5064–5068, 2022, doi: <a href="https://doi.org/10.1021/acsomega.1c06019">10.1021/acsomega.1c06019</a>.'
  mla: Karmo, Marsel, et al. “Reconstructions of the As-Terminated GaAs(001) Surface
    Exposed to Atomic Hydrogen.” <i>ACS Omega</i>, vol. 7, no. 6, American Chemical
    Society (ACS), 2022, pp. 5064–68, doi:<a href="https://doi.org/10.1021/acsomega.1c06019">10.1021/acsomega.1c06019</a>.
  short: M. Karmo, I.A. Ruiz Alvarado, W.G. Schmidt, E. Runge, ACS Omega 7 (2022)
    5064–5068.
date_created: 2023-01-20T11:25:13Z
date_updated: 2023-04-20T14:31:21Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '230'
- _id: '35'
doi: 10.1021/acsomega.1c06019
intvolume: '         7'
issue: '6'
keyword:
- General Chemical Engineering
- General Chemistry
language:
- iso: eng
page: 5064-5068
publication: ACS Omega
publication_identifier:
  issn:
  - 2470-1343
  - 2470-1343
publication_status: published
publisher: American Chemical Society (ACS)
status: public
title: Reconstructions of the As-Terminated GaAs(001) Surface Exposed to Atomic Hydrogen
type: journal_article
user_id: '16199'
volume: 7
year: '2022'
...
---
_id: '22009'
author:
- first_name: Isaac Azahel
  full_name: Ruiz Alvarado, Isaac Azahel
  id: '79462'
  last_name: Ruiz Alvarado
  orcid: 0000-0002-4710-1170
- first_name: Marsel
  full_name: Karmo, Marsel
  last_name: Karmo
- first_name: Erich
  full_name: Runge, Erich
  last_name: Runge
- first_name: Wolf Gero
  full_name: Schmidt, Wolf Gero
  id: '468'
  last_name: Schmidt
  orcid: 0000-0002-2717-5076
citation:
  ama: Ruiz Alvarado IA, Karmo M, Runge E, Schmidt WG. InP and AlInP(001)(2 × 4) Surface
    Oxidation from Density Functional Theory. <i>ACS Omega</i>. Published online 2021:6297-6304.
    doi:<a href="https://doi.org/10.1021/acsomega.0c06019">10.1021/acsomega.0c06019</a>
  apa: Ruiz Alvarado, I. A., Karmo, M., Runge, E., &#38; Schmidt, W. G. (2021). InP
    and AlInP(001)(2 × 4) Surface Oxidation from Density Functional Theory. <i>ACS
    Omega</i>, 6297–6304. <a href="https://doi.org/10.1021/acsomega.0c06019">https://doi.org/10.1021/acsomega.0c06019</a>
  bibtex: '@article{Ruiz Alvarado_Karmo_Runge_Schmidt_2021, title={InP and AlInP(001)(2
    × 4) Surface Oxidation from Density Functional Theory}, DOI={<a href="https://doi.org/10.1021/acsomega.0c06019">10.1021/acsomega.0c06019</a>},
    journal={ACS Omega}, author={Ruiz Alvarado, Isaac Azahel and Karmo, Marsel and
    Runge, Erich and Schmidt, Wolf Gero}, year={2021}, pages={6297–6304} }'
  chicago: Ruiz Alvarado, Isaac Azahel, Marsel Karmo, Erich Runge, and Wolf Gero Schmidt.
    “InP and AlInP(001)(2 × 4) Surface Oxidation from Density Functional Theory.”
    <i>ACS Omega</i>, 2021, 6297–6304. <a href="https://doi.org/10.1021/acsomega.0c06019">https://doi.org/10.1021/acsomega.0c06019</a>.
  ieee: 'I. A. Ruiz Alvarado, M. Karmo, E. Runge, and W. G. Schmidt, “InP and AlInP(001)(2
    × 4) Surface Oxidation from Density Functional Theory,” <i>ACS Omega</i>, pp.
    6297–6304, 2021, doi: <a href="https://doi.org/10.1021/acsomega.0c06019">10.1021/acsomega.0c06019</a>.'
  mla: Ruiz Alvarado, Isaac Azahel, et al. “InP and AlInP(001)(2 × 4) Surface Oxidation
    from Density Functional Theory.” <i>ACS Omega</i>, 2021, pp. 6297–304, doi:<a
    href="https://doi.org/10.1021/acsomega.0c06019">10.1021/acsomega.0c06019</a>.
  short: I.A. Ruiz Alvarado, M. Karmo, E. Runge, W.G. Schmidt, ACS Omega (2021) 6297–6304.
date_created: 2021-05-06T12:51:02Z
date_updated: 2023-04-20T14:27:13Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '230'
- _id: '35'
doi: 10.1021/acsomega.0c06019
language:
- iso: eng
page: 6297-6304
project:
- _id: '52'
  name: Computing Resources Provided by the Paderborn Center for Parallel Computing
- _id: '52'
  name: 'PC2: Computing Resources Provided by the Paderborn Center for Parallel Computing'
publication: ACS Omega
publication_identifier:
  issn:
  - 2470-1343
  - 2470-1343
publication_status: published
status: public
title: InP and AlInP(001)(2 × 4) Surface Oxidation from Density Functional Theory
type: journal_article
user_id: '16199'
year: '2021'
...
---
_id: '23781'
author:
- first_name: Mayurkumar P.
  full_name: Patil, Mayurkumar P.
  last_name: Patil
- first_name: Prakash D.
  full_name: Vaidya, Prakash D.
  last_name: Vaidya
- first_name: Eugeny
  full_name: Kenig, Eugeny
  id: '665'
  last_name: Kenig
citation:
  ama: Patil MP, Vaidya PD, Kenig E. Kinetics of Carbon Dioxide Removal Using N-Acetylglucosamine.
    <i>ACS Omega</i>. 2020;5:27043-27049. doi:<a href="https://doi.org/10.1021/acsomega.0c02076">10.1021/acsomega.0c02076</a>
  apa: Patil, M. P., Vaidya, P. D., &#38; Kenig, E. (2020). Kinetics of Carbon Dioxide
    Removal Using N-Acetylglucosamine. <i>ACS Omega</i>, <i>5</i>, 27043–27049. <a
    href="https://doi.org/10.1021/acsomega.0c02076">https://doi.org/10.1021/acsomega.0c02076</a>
  bibtex: '@article{Patil_Vaidya_Kenig_2020, title={Kinetics of Carbon Dioxide Removal
    Using N-Acetylglucosamine}, volume={5}, DOI={<a href="https://doi.org/10.1021/acsomega.0c02076">10.1021/acsomega.0c02076</a>},
    journal={ACS Omega}, author={Patil, Mayurkumar P. and Vaidya, Prakash D. and Kenig,
    Eugeny}, year={2020}, pages={27043–27049} }'
  chicago: 'Patil, Mayurkumar P., Prakash D. Vaidya, and Eugeny Kenig. “Kinetics of
    Carbon Dioxide Removal Using N-Acetylglucosamine.” <i>ACS Omega</i> 5 (2020):
    27043–49. <a href="https://doi.org/10.1021/acsomega.0c02076">https://doi.org/10.1021/acsomega.0c02076</a>.'
  ieee: 'M. P. Patil, P. D. Vaidya, and E. Kenig, “Kinetics of Carbon Dioxide Removal
    Using N-Acetylglucosamine,” <i>ACS Omega</i>, vol. 5, pp. 27043–27049, 2020, doi:
    <a href="https://doi.org/10.1021/acsomega.0c02076">10.1021/acsomega.0c02076</a>.'
  mla: Patil, Mayurkumar P., et al. “Kinetics of Carbon Dioxide Removal Using N-Acetylglucosamine.”
    <i>ACS Omega</i>, vol. 5, 2020, pp. 27043–49, doi:<a href="https://doi.org/10.1021/acsomega.0c02076">10.1021/acsomega.0c02076</a>.
  short: M.P. Patil, P.D. Vaidya, E. Kenig, ACS Omega 5 (2020) 27043–27049.
date_created: 2021-09-06T09:35:14Z
date_updated: 2022-01-06T06:55:59Z
department:
- _id: '9'
- _id: '145'
doi: 10.1021/acsomega.0c02076
intvolume: '         5'
language:
- iso: eng
page: 27043-27049
publication: ACS Omega
publication_identifier:
  issn:
  - 2470-1343
  - 2470-1343
publication_status: published
status: public
title: Kinetics of Carbon Dioxide Removal Using N-Acetylglucosamine
type: journal_article
user_id: '22006'
volume: 5
year: '2020'
...
---
_id: '19654'
author:
- first_name: Marvin
  full_name: Krenz, Marvin
  id: '52309'
  last_name: Krenz
- first_name: Uwe
  full_name: Gerstmann, Uwe
  id: '171'
  last_name: Gerstmann
  orcid: 0000-0002-4476-223X
- first_name: Wolf Gero
  full_name: Schmidt, Wolf Gero
  id: '468'
  last_name: Schmidt
  orcid: 0000-0002-2717-5076
citation:
  ama: Krenz M, Gerstmann U, Schmidt WG. Photochemical Ring Opening of Oxirane Modeled
    by Constrained Density Functional Theory. <i>ACS Omega</i>. Published online 2020:24057-24063.
    doi:<a href="https://doi.org/10.1021/acsomega.0c03483">10.1021/acsomega.0c03483</a>
  apa: Krenz, M., Gerstmann, U., &#38; Schmidt, W. G. (2020). Photochemical Ring Opening
    of Oxirane Modeled by Constrained Density Functional Theory. <i>ACS Omega</i>,
    24057–24063. <a href="https://doi.org/10.1021/acsomega.0c03483">https://doi.org/10.1021/acsomega.0c03483</a>
  bibtex: '@article{Krenz_Gerstmann_Schmidt_2020, title={Photochemical Ring Opening
    of Oxirane Modeled by Constrained Density Functional Theory}, DOI={<a href="https://doi.org/10.1021/acsomega.0c03483">10.1021/acsomega.0c03483</a>},
    journal={ACS Omega}, author={Krenz, Marvin and Gerstmann, Uwe and Schmidt, Wolf
    Gero}, year={2020}, pages={24057–24063} }'
  chicago: Krenz, Marvin, Uwe Gerstmann, and Wolf Gero Schmidt. “Photochemical Ring
    Opening of Oxirane Modeled by Constrained Density Functional Theory.” <i>ACS Omega</i>,
    2020, 24057–63. <a href="https://doi.org/10.1021/acsomega.0c03483">https://doi.org/10.1021/acsomega.0c03483</a>.
  ieee: 'M. Krenz, U. Gerstmann, and W. G. Schmidt, “Photochemical Ring Opening of
    Oxirane Modeled by Constrained Density Functional Theory,” <i>ACS Omega</i>, pp.
    24057–24063, 2020, doi: <a href="https://doi.org/10.1021/acsomega.0c03483">10.1021/acsomega.0c03483</a>.'
  mla: Krenz, Marvin, et al. “Photochemical Ring Opening of Oxirane Modeled by Constrained
    Density Functional Theory.” <i>ACS Omega</i>, 2020, pp. 24057–63, doi:<a href="https://doi.org/10.1021/acsomega.0c03483">10.1021/acsomega.0c03483</a>.
  short: M. Krenz, U. Gerstmann, W.G. Schmidt, ACS Omega (2020) 24057–24063.
date_created: 2020-09-24T11:10:47Z
date_updated: 2023-04-20T16:06:43Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '230'
- _id: '35'
- _id: '790'
doi: 10.1021/acsomega.0c03483
language:
- iso: eng
page: 24057-24063
project:
- _id: '52'
  name: Computing Resources Provided by the Paderborn Center for Parallel Computing
- _id: '52'
  name: 'PC2: Computing Resources Provided by the Paderborn Center for Parallel Computing'
publication: ACS Omega
publication_identifier:
  issn:
  - 2470-1343
  - 2470-1343
publication_status: published
status: public
title: Photochemical Ring Opening of Oxirane Modeled by Constrained Density Functional
  Theory
type: journal_article
user_id: '16199'
year: '2020'
...
---
_id: '22657'
author:
- first_name: Roozbeh
  full_name: Hajiraissi, Roozbeh
  last_name: Hajiraissi
- first_name: Marcel
  full_name: Hanke, Marcel
  last_name: Hanke
- first_name: Alejandro
  full_name: Gonzalez Orive, Alejandro
  last_name: Gonzalez Orive
- first_name: Belma
  full_name: Duderija, Belma
  id: '54863'
  last_name: Duderija
- first_name: Ulrike
  full_name: Hofmann, Ulrike
  last_name: Hofmann
- first_name: Yixin
  full_name: Zhang, Yixin
  last_name: Zhang
- first_name: Guido
  full_name: Grundmeier, Guido
  id: '194'
  last_name: Grundmeier
- first_name: Adrian
  full_name: Keller, Adrian
  id: '48864'
  last_name: Keller
  orcid: 0000-0001-7139-3110
citation:
  ama: Hajiraissi R, Hanke M, Gonzalez Orive A, et al. Effect of Terminal Modifications
    on the Adsorption and Assembly of hIAPP(20–29). <i>ACS Omega</i>. 2019;4:2649-2660.
    doi:<a href="https://doi.org/10.1021/acsomega.8b03028">10.1021/acsomega.8b03028</a>
  apa: Hajiraissi, R., Hanke, M., Gonzalez Orive, A., Duderija, B., Hofmann, U., Zhang,
    Y., … Keller, A. (2019). Effect of Terminal Modifications on the Adsorption and
    Assembly of hIAPP(20–29). <i>ACS Omega</i>, <i>4</i>, 2649–2660. <a href="https://doi.org/10.1021/acsomega.8b03028">https://doi.org/10.1021/acsomega.8b03028</a>
  bibtex: '@article{Hajiraissi_Hanke_Gonzalez Orive_Duderija_Hofmann_Zhang_Grundmeier_Keller_2019,
    title={Effect of Terminal Modifications on the Adsorption and Assembly of hIAPP(20–29)},
    volume={4}, DOI={<a href="https://doi.org/10.1021/acsomega.8b03028">10.1021/acsomega.8b03028</a>},
    journal={ACS Omega}, author={Hajiraissi, Roozbeh and Hanke, Marcel and Gonzalez
    Orive, Alejandro and Duderija, Belma and Hofmann, Ulrike and Zhang, Yixin and
    Grundmeier, Guido and Keller, Adrian}, year={2019}, pages={2649–2660} }'
  chicago: 'Hajiraissi, Roozbeh, Marcel Hanke, Alejandro Gonzalez Orive, Belma Duderija,
    Ulrike Hofmann, Yixin Zhang, Guido Grundmeier, and Adrian Keller. “Effect of Terminal
    Modifications on the Adsorption and Assembly of HIAPP(20–29).” <i>ACS Omega</i>
    4 (2019): 2649–60. <a href="https://doi.org/10.1021/acsomega.8b03028">https://doi.org/10.1021/acsomega.8b03028</a>.'
  ieee: R. Hajiraissi <i>et al.</i>, “Effect of Terminal Modifications on the Adsorption
    and Assembly of hIAPP(20–29),” <i>ACS Omega</i>, vol. 4, pp. 2649–2660, 2019.
  mla: Hajiraissi, Roozbeh, et al. “Effect of Terminal Modifications on the Adsorption
    and Assembly of HIAPP(20–29).” <i>ACS Omega</i>, vol. 4, 2019, pp. 2649–60, doi:<a
    href="https://doi.org/10.1021/acsomega.8b03028">10.1021/acsomega.8b03028</a>.
  short: R. Hajiraissi, M. Hanke, A. Gonzalez Orive, B. Duderija, U. Hofmann, Y. Zhang,
    G. Grundmeier, A. Keller, ACS Omega 4 (2019) 2649–2660.
date_created: 2021-07-08T12:16:52Z
date_updated: 2022-01-06T06:55:38Z
department:
- _id: '302'
doi: 10.1021/acsomega.8b03028
intvolume: '         4'
language:
- iso: eng
page: 2649-2660
publication: ACS Omega
publication_identifier:
  issn:
  - 2470-1343
  - 2470-1343
publication_status: published
status: public
title: Effect of Terminal Modifications on the Adsorption and Assembly of hIAPP(20–29)
type: journal_article
user_id: '48864'
volume: 4
year: '2019'
...
---
_id: '10015'
author:
- first_name: Christof
  full_name: Dues, Christof
  last_name: Dues
- first_name: Wolf Gero
  full_name: Schmidt, Wolf Gero
  id: '468'
  last_name: Schmidt
  orcid: 0000-0002-2717-5076
- first_name: Simone
  full_name: Sanna, Simone
  last_name: Sanna
citation:
  ama: Dues C, Schmidt WG, Sanna S. Water Splitting Reaction at Polar Lithium Niobate
    Surfaces. <i>ACS Omega</i>. Published online 2019:3850-3859. doi:<a href="https://doi.org/10.1021/acsomega.8b03271">10.1021/acsomega.8b03271</a>
  apa: Dues, C., Schmidt, W. G., &#38; Sanna, S. (2019). Water Splitting Reaction
    at Polar Lithium Niobate Surfaces. <i>ACS Omega</i>, 3850–3859. <a href="https://doi.org/10.1021/acsomega.8b03271">https://doi.org/10.1021/acsomega.8b03271</a>
  bibtex: '@article{Dues_Schmidt_Sanna_2019, title={Water Splitting Reaction at Polar
    Lithium Niobate Surfaces}, DOI={<a href="https://doi.org/10.1021/acsomega.8b03271">10.1021/acsomega.8b03271</a>},
    journal={ACS Omega}, author={Dues, Christof and Schmidt, Wolf Gero and Sanna,
    Simone}, year={2019}, pages={3850–3859} }'
  chicago: Dues, Christof, Wolf Gero Schmidt, and Simone Sanna. “Water Splitting Reaction
    at Polar Lithium Niobate Surfaces.” <i>ACS Omega</i>, 2019, 3850–59. <a href="https://doi.org/10.1021/acsomega.8b03271">https://doi.org/10.1021/acsomega.8b03271</a>.
  ieee: 'C. Dues, W. G. Schmidt, and S. Sanna, “Water Splitting Reaction at Polar
    Lithium Niobate Surfaces,” <i>ACS Omega</i>, pp. 3850–3859, 2019, doi: <a href="https://doi.org/10.1021/acsomega.8b03271">10.1021/acsomega.8b03271</a>.'
  mla: Dues, Christof, et al. “Water Splitting Reaction at Polar Lithium Niobate Surfaces.”
    <i>ACS Omega</i>, 2019, pp. 3850–59, doi:<a href="https://doi.org/10.1021/acsomega.8b03271">10.1021/acsomega.8b03271</a>.
  short: C. Dues, W.G. Schmidt, S. Sanna, ACS Omega (2019) 3850–3859.
date_created: 2019-05-29T07:15:06Z
date_updated: 2023-04-20T14:21:28Z
department:
- _id: '15'
- _id: '170'
- _id: '295'
- _id: '35'
doi: 10.1021/acsomega.8b03271
funded_apc: '1'
language:
- iso: eng
page: 3850-3859
project:
- _id: '52'
  name: Computing Resources Provided by the Paderborn Center for Parallel Computing
- _id: '53'
  name: TRR 142
- _id: '55'
  name: TRR 142 - Project Area B
- _id: '69'
  name: TRR 142 - Subproject B4
- _id: '52'
  name: 'PC2: Computing Resources Provided by the Paderborn Center for Parallel Computing'
publication: ACS Omega
publication_identifier:
  issn:
  - 2470-1343
  - 2470-1343
publication_status: published
status: public
title: Water Splitting Reaction at Polar Lithium Niobate Surfaces
type: journal_article
user_id: '16199'
year: '2019'
...
---
_id: '22661'
author:
- first_name: Fabian
  full_name: Kollmann, Fabian
  last_name: Kollmann
- first_name: Saminathan
  full_name: Ramakrishnan, Saminathan
  last_name: Ramakrishnan
- first_name: Boxuan
  full_name: Shen, Boxuan
  last_name: Shen
- first_name: Guido
  full_name: Grundmeier, Guido
  id: '194'
  last_name: Grundmeier
- first_name: Mauri A.
  full_name: Kostiainen, Mauri A.
  last_name: Kostiainen
- first_name: Veikko
  full_name: Linko, Veikko
  last_name: Linko
- first_name: Adrian
  full_name: Keller, Adrian
  id: '48864'
  last_name: Keller
  orcid: 0000-0001-7139-3110
citation:
  ama: Kollmann F, Ramakrishnan S, Shen B, et al. Superstructure-Dependent Loading
    of DNA Origami Nanostructures with a Groove-Binding Drug. <i>ACS Omega</i>. 2018;3:9441-9448.
    doi:<a href="https://doi.org/10.1021/acsomega.8b00934">10.1021/acsomega.8b00934</a>
  apa: Kollmann, F., Ramakrishnan, S., Shen, B., Grundmeier, G., Kostiainen, M. A.,
    Linko, V., &#38; Keller, A. (2018). Superstructure-Dependent Loading of DNA Origami
    Nanostructures with a Groove-Binding Drug. <i>ACS Omega</i>, <i>3</i>, 9441–9448.
    <a href="https://doi.org/10.1021/acsomega.8b00934">https://doi.org/10.1021/acsomega.8b00934</a>
  bibtex: '@article{Kollmann_Ramakrishnan_Shen_Grundmeier_Kostiainen_Linko_Keller_2018,
    title={Superstructure-Dependent Loading of DNA Origami Nanostructures with a Groove-Binding
    Drug}, volume={3}, DOI={<a href="https://doi.org/10.1021/acsomega.8b00934">10.1021/acsomega.8b00934</a>},
    journal={ACS Omega}, author={Kollmann, Fabian and Ramakrishnan, Saminathan and
    Shen, Boxuan and Grundmeier, Guido and Kostiainen, Mauri A. and Linko, Veikko
    and Keller, Adrian}, year={2018}, pages={9441–9448} }'
  chicago: 'Kollmann, Fabian, Saminathan Ramakrishnan, Boxuan Shen, Guido Grundmeier,
    Mauri A. Kostiainen, Veikko Linko, and Adrian Keller. “Superstructure-Dependent
    Loading of DNA Origami Nanostructures with a Groove-Binding Drug.” <i>ACS Omega</i>
    3 (2018): 9441–48. <a href="https://doi.org/10.1021/acsomega.8b00934">https://doi.org/10.1021/acsomega.8b00934</a>.'
  ieee: F. Kollmann <i>et al.</i>, “Superstructure-Dependent Loading of DNA Origami
    Nanostructures with a Groove-Binding Drug,” <i>ACS Omega</i>, vol. 3, pp. 9441–9448,
    2018.
  mla: Kollmann, Fabian, et al. “Superstructure-Dependent Loading of DNA Origami Nanostructures
    with a Groove-Binding Drug.” <i>ACS Omega</i>, vol. 3, 2018, pp. 9441–48, doi:<a
    href="https://doi.org/10.1021/acsomega.8b00934">10.1021/acsomega.8b00934</a>.
  short: F. Kollmann, S. Ramakrishnan, B. Shen, G. Grundmeier, M.A. Kostiainen, V.
    Linko, A. Keller, ACS Omega 3 (2018) 9441–9448.
date_created: 2021-07-08T12:20:49Z
date_updated: 2022-01-06T06:55:38Z
department:
- _id: '302'
doi: 10.1021/acsomega.8b00934
intvolume: '         3'
language:
- iso: eng
page: 9441-9448
publication: ACS Omega
publication_identifier:
  issn:
  - 2470-1343
  - 2470-1343
publication_status: published
status: public
title: Superstructure-Dependent Loading of DNA Origami Nanostructures with a Groove-Binding
  Drug
type: journal_article
user_id: '48864'
volume: 3
year: '2018'
...