Comparing transmembrane protein structures with ATOLL by Jacquemard, Célien, Bret, Guillaume, Grutter, Thomas, Kellenberger, Esther

Request full text

LIT-PCBA: An Unbiased Data Set for Machine Learning and Virtual Screening by Tran-Nguyen, Viet-Khoa, Jacquemard, Célien, Rognan, Didier

Get full text

Modeling of CCR5 Recognition by HIV-1 gp120: How the Viral Protein Exploits the Conformational Plasticity of the Coreceptor by Jacquemard, Célien, Koensgen, Florian, Colin, Philippe, Lagane, Bernard, Kellenberger, Esther

Get full text

Comprehensive analysis of commercial fragment libraries by Revillo Imbernon, Julia, Jacquemard, Célien, Bret, Guillaume, Marcou, Gilles, Kellenberger, Esther

Get full text

Local Interaction Density (LID), a Fast and Efficient Tool to Prioritize Docking Poses by Jacquemard, Célien, Tran-Nguyen, Viet-Khoa, Drwal, Malgorzata N, Rognan, Didier, Kellenberger, Esther

Get full text

Binding mode information improves fragment docking by Jacquemard, Célien, Drwal, Malgorzata N., Desaphy, Jérémy, Kellenberger, Esther

Get full text

Benchmarking AlphaFold-Generated Structures of Chemokine–Chemokine Receptor Complexes by Urvas, Lauri, Chiesa, Luca, Bret, Guillaume, Jacquemard, Célien, Kellenberger, Esther

Get full text

Structural Insights on Fragment Binding Mode Conservation by Drwal, Malgorzata N, Bret, Guillaume, Perez, Carlos, Jacquemard, Célien, Desaphy, Jérémy, Kellenberger, Esther

Get full text

Do Fragments and Crystallization Additives Bind Similarly to Drug-like Ligands? by Drwal, Malgorzata N, Jacquemard, Célien, Perez, Carlos, Desaphy, Jérémy, Kellenberger, Esther

Get full text

LIT-PCBA: An Unbiased Dataset for Machine Learning and Virtual Screening by Tran-Nguyen, Viet-Khoa, Jacquemard, Célien, Rognan, Didier

Get full text

CACHE Challenge #1: Targeting the WDR Domain of LRRK2, A Parkinson’s Disease Associated Protein by Li, Fengling, Ackloo, Suzanne, Arrowsmith, Cheryl H., Ban, Fuqiang, Barden, Christopher J., Beck, Hartmut, Beránek, Jan, Berenger, Francois, Bolotokova, Albina, Bret, Guillaume, Breznik, Marko, Carosati, Emanuele, Chau, Irene, Chen, Yu, Cherkasov, Artem, Corte, Dennis Della, Denzinger, Katrin, Dong, Aiping, Draga, Sorin, Dunn, Ian, Edfeldt, Kristina, Edwards, Aled, Eguida, Merveille, Eisenhuth, Paul, Friedrich, Lukas, Fuerll, Alexander, Gardiner, Spencer S, Gentile, Francesco, Ghiabi, Pegah, Gibson, Elisa, Glavatskikh, Marta, Gorgulla, Christoph, Guenther, Judith, Gunnarsson, Anders, Gusev, Filipp, Gutkin, Evgeny, Halabelian, Levon, Harding, Rachel J., Hillisch, Alexander, Hoffer, Laurent, Hogner, Anders, Houliston, Scott, Irwin, John J, Isayev, Olexandr, Ivanova, Aleksandra, Jacquemard, Celien, Jarrett, Austin J, Jensen, Jan H., Kireev, Dmitri, Kleber, Julian, Koby, S. Benjamin, Koes, David, Kumar, Ashutosh, Kurnikova, Maria G., Kutlushina, Alina, Lessel, Uta, Liessmann, Fabian, Liu, Sijie, Lu, Wei, Meiler, Jens, Mettu, Akhila, Minibaeva, Guzel, Moretti, Rocco, Morris, Connor J, Narangoda, Chamali, Noonan, Theresa, Obendorf, Leon, Pach, Szymon, Pandit, Amit, Perveen, Sumera, Poda, Gennady, Polishchuk, Pavel, Puls, Kristina, Pütter, Vera, Rognan, Didier, Roskams-Edris, Dylan, Schindler, Christina, Sindt, François, Spiwok, Vojtěch, Steinmann, Casper, Stevens, Rick L., Talagayev, Valerij, Tingey, Damon, Vu, Oanh, Walters, W. Patrick, Wang, Xiaowen, Wang, Zhenyu, Wolber, Gerhard, Wolf, Clemens Alexander, Wortmann, Lars, Zeng, Hong, Zepeda, Carlos A., Zhang, Kam Y. J., Zhang, Jixian, Zheng, Shuangjia, Schapira, Matthieu

Get full text