CACHE Challenge #3: Targeting the Nsp3 Macrodomain of SARS-CoV-2

Oleksandra Herasymenko, Madhushika Silva, Galen J. Correy, Abd Al-Aziz A. Abu-Saleh, Suzanne Ackloo, Cheryl Arrowsmith, Alan Ashworth, Fuqiang Ban, Hartmut Beck, Kevin P. Bishop, Hugo J. Bohórquez, Albina Bolotokova, Marko Breznik, Irene Chau, Yu Chen, Artem Cherkasov, Wim Dehaen, Dennis Della Corte, Katrin Denzinger, Niklas P. Doering, Kristina Edfeldt, Aled Edwards, Darren Fayne, Francesco Gentile, Elisa Gibson, Ozan Gokdemir, Anders Gunnarsson, Judith Günther, John J. Irwin, Jan Halborg Jensen, Rachel J. Harding, Alexander Hillisch, Laurent Hoffer, Anders Hogner, Ashley Hutchinson, Shubhangi Kandwal, Andrea Karlova, Kushal Koirala, Sergei Kotelnikov, Dima Kozakov, Juyong Lee, Soowon Lee, Uta Lessel, Sijie Liu, Xuefeng Liu, Peter Loppnau, Jens Meiler, Rocco Moretti, Yurii S. Moroz, Charuvaka Muvva, Tudor I. Oprea, Brooks Paige, Amit Pandit, Keunwan Park, Gennady Poda, Mykola V. Protopopov, Vera Pütter, Rahul Ravichandran, Didier Rognan, Edina Rosta, Yogesh Sabnis, Thomas Scott, Almagul Seitova, Purshotam Sharma, François Sindt, Minghu Song, Casper Steinmann, Rick Stevens, Valerij Talagayev, Valentyna V. Tararina, Olga Tarkhanova, Damon Tingey, John F. Trant, Dakota Treleaven, Alexander Tropsha, Patrick Walters, Jude Wells, Yvonne Westermaier, Gerhard Wolber, Lars Wortmann, Shuangjia Zheng, James S. Fraser, Matthieu Schapira

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DOI
10.1021/acs.jcim.5c02441
Published
2026-01-21
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.5c02441,
  title = {CACHE Challenge \#3: Targeting the Nsp3 Macrodomain of SARS-CoV-2},
  author = {Oleksandra Herasymenko and Madhushika Silva and Galen J. Correy and Abd Al-Aziz A. Abu-Saleh and Suzanne Ackloo and Cheryl Arrowsmith and Alan Ashworth and Fuqiang Ban and Hartmut Beck and Kevin P. Bishop and Hugo J. Bohórquez and Albina Bolotokova and Marko Breznik and Irene Chau and Yu Chen and Artem Cherkasov and Wim Dehaen and Dennis Della Corte and Katrin Denzinger and Niklas P. Doering and Kristina Edfeldt and Aled Edwards and Darren Fayne and Francesco Gentile and Elisa Gibson and Ozan Gokdemir and Anders Gunnarsson and Judith Günther and John J. Irwin and Jan Halborg Jensen and Rachel J. Harding and Alexander Hillisch and Laurent Hoffer and Anders Hogner and Ashley Hutchinson and Shubhangi Kandwal and Andrea Karlova and Kushal Koirala and Sergei Kotelnikov and Dima Kozakov and Juyong Lee and Soowon Lee and Uta Lessel and Sijie Liu and Xuefeng Liu and Peter Loppnau and Jens Meiler and Rocco Moretti and Yurii S. Moroz and Charuvaka Muvva and Tudor I. Oprea and Brooks Paige and Amit Pandit and Keunwan Park and Gennady Poda and Mykola V. Protopopov and Vera Pütter and Rahul Ravichandran and Didier Rognan and Edina Rosta and Yogesh Sabnis and Thomas Scott and Almagul Seitova and Purshotam Sharma and François Sindt and Minghu Song and Casper Steinmann and Rick Stevens and Valerij Talagayev and Valentyna V. Tararina and Olga Tarkhanova and Damon Tingey and John F. Trant and Dakota Treleaven and Alexander Tropsha and Patrick Walters and Jude Wells and Yvonne Westermaier and Gerhard Wolber and Lars Wortmann and Shuangjia Zheng and James S. Fraser and Matthieu Schapira},
  year = {2026},
  journal = {Journal of Chemical Information and Modeling},
  doi = {10.1021/acs.jcim.5c02441},
  url = {https://doi.org/10.1021/acs.jcim.5c02441}
}

RIS

TY  - JOUR
TI  - CACHE Challenge #3: Targeting the Nsp3 Macrodomain of SARS-CoV-2
AU  - Oleksandra Herasymenko
AU  - Madhushika Silva
AU  - Galen J. Correy
AU  - Abd Al-Aziz A. Abu-Saleh
AU  - Suzanne Ackloo
AU  - Cheryl Arrowsmith
AU  - Alan Ashworth
AU  - Fuqiang Ban
AU  - Hartmut Beck
AU  - Kevin P. Bishop
AU  - Hugo J. Bohórquez
AU  - Albina Bolotokova
AU  - Marko Breznik
AU  - Irene Chau
AU  - Yu Chen
AU  - Artem Cherkasov
AU  - Wim Dehaen
AU  - Dennis Della Corte
AU  - Katrin Denzinger
AU  - Niklas P. Doering
AU  - Kristina Edfeldt
AU  - Aled Edwards
AU  - Darren Fayne
AU  - Francesco Gentile
AU  - Elisa Gibson
AU  - Ozan Gokdemir
AU  - Anders Gunnarsson
AU  - Judith Günther
AU  - John J. Irwin
AU  - Jan Halborg Jensen
AU  - Rachel J. Harding
AU  - Alexander Hillisch
AU  - Laurent Hoffer
AU  - Anders Hogner
AU  - Ashley Hutchinson
AU  - Shubhangi Kandwal
AU  - Andrea Karlova
AU  - Kushal Koirala
AU  - Sergei Kotelnikov
AU  - Dima Kozakov
AU  - Juyong Lee
AU  - Soowon Lee
AU  - Uta Lessel
AU  - Sijie Liu
AU  - Xuefeng Liu
AU  - Peter Loppnau
AU  - Jens Meiler
AU  - Rocco Moretti
AU  - Yurii S. Moroz
AU  - Charuvaka Muvva
AU  - Tudor I. Oprea
AU  - Brooks Paige
AU  - Amit Pandit
AU  - Keunwan Park
AU  - Gennady Poda
AU  - Mykola V. Protopopov
AU  - Vera Pütter
AU  - Rahul Ravichandran
AU  - Didier Rognan
AU  - Edina Rosta
AU  - Yogesh Sabnis
AU  - Thomas Scott
AU  - Almagul Seitova
AU  - Purshotam Sharma
AU  - François Sindt
AU  - Minghu Song
AU  - Casper Steinmann
AU  - Rick Stevens
AU  - Valerij Talagayev
AU  - Valentyna V. Tararina
AU  - Olga Tarkhanova
AU  - Damon Tingey
AU  - John F. Trant
AU  - Dakota Treleaven
AU  - Alexander Tropsha
AU  - Patrick Walters
AU  - Jude Wells
AU  - Yvonne Westermaier
AU  - Gerhard Wolber
AU  - Lars Wortmann
AU  - Shuangjia Zheng
AU  - James S. Fraser
AU  - Matthieu Schapira
PY  - 2026
JO  - Journal of Chemical Information and Modeling
DO  - 10.1021/acs.jcim.5c02441
UR  - https://doi.org/10.1021/acs.jcim.5c02441
ER  - 

APA

Herasymenko, O., Silva, M., Correy, G. J., Abu-Saleh, A. A. A., Ackloo, S., Arrowsmith, C., Ashworth, A., Ban, F., Beck, H., Bishop, K. P., Bohórquez, H. J., Bolotokova, A., Breznik, M., Chau, I., Chen, Y., Cherkasov, A., Dehaen, W., Corte, D. D., Denzinger, K., Doering, N. P., Edfeldt, K., Edwards, A., Fayne, D., Gentile, F., Gibson, E., Gokdemir, O., Gunnarsson, A., Günther, J., Irwin, J. J., Jensen, J. H., Harding, R. J., Hillisch, A., Hoffer, L., Hogner, A., Hutchinson, A., Kandwal, S., Karlova, A., Koirala, K., Kotelnikov, S., Kozakov, D., Lee, J., Lee, S., Lessel, U., Liu, S., Liu, X., Loppnau, P., Meiler, J., Moretti, R., Moroz, Y. S., Muvva, C., Oprea, T. I., Paige, B., Pandit, A., Park, K., Poda, G., Protopopov, M. V., Pütter, V., Ravichandran, R., Rognan, D., Rosta, E., Sabnis, Y., Scott, T., Seitova, A., Sharma, P., Sindt, F., Song, M., Steinmann, C., Stevens, R., Talagayev, V., Tararina, V. V., Tarkhanova, O., Tingey, D., Trant, J. F., Treleaven, D., Tropsha, A., Walters, P., Wells, J., Westermaier, Y., Wolber, G., Wortmann, L., Zheng, S., Fraser, J. S., & Schapira, M. (2026). CACHE Challenge #3: Targeting the Nsp3 Macrodomain of SARS-CoV-2. Journal of Chemical Information and Modeling. https://doi.org/10.1021/acs.jcim.5c02441

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