Zobrazeno 1 - 10
of 18
pro vyhledávání: '"Aurélien F. A. Moumbock"'
Autor:
Antonia Grauel, Jan Kägi, Tim Rasmussen, Iryna Makarchuk, Sabrina Oppermann, Aurélien F. A. Moumbock, Daniel Wohlwend, Rolf Müller, Frederic Melin, Stefan Günther, Petra Hellwig, Bettina Böttcher, Thorsten Friedrich
Publikováno v:
Nature Communications, Vol 12, Iss 1, Pp 1-11 (2021)
Terminal bd oxidases endow bacterial pathogens with resistance to cellular stressors. The authors report the structure of E. coli bd-II type oxidase with the bound inhibitor aurachin D, providing a structural basis for the design of specifically bind
Externí odkaz:
https://doaj.org/article/20085e0d8d9048149ac18c44b6585ba4
Autor:
Paul F Zierep, Randi Vita, Nina Blazeska, Aurélien F A Moumbock, Jason A Greenbaum, Bjoern Peters, Stefan Günther
Publikováno v:
PLoS Computational Biology, Vol 18, Iss 2, p e1009151 (2022)
In-silico methods for the prediction of epitopes can support and improve workflows for vaccine design, antibody production, and disease therapy. So far, the scope of B cell and T cell epitope prediction has been directed exclusively towards peptidic
Externí odkaz:
https://doaj.org/article/ec6ef0c617494645ae0d20f9ca33399a
Autor:
Kersten Döring, Ammar Qaseem, Michael Becer, Jianyu Li, Pankaj Mishra, Mingjie Gao, Pascal Kirchner, Florian Sauter, Kiran K Telukunta, Aurélien F A Moumbock, Philippe Thomas, Stefan Günther
Publikováno v:
PLoS ONE, Vol 15, Iss 3, p e0220925 (2020)
MOTIVATION:Much effort has been invested in the identification of protein-protein interactions using text mining and machine learning methods. The extraction of functional relationships between chemical compounds and proteins from literature has rece
Externí odkaz:
https://doaj.org/article/bd52bdcda3eb4a59ac2ec64f731edda5
Autor:
Yue Feng, Aurélien F. A. Moumbock, Dan Wang, Jianyu Li, Qianqing Xu, Ammar Qaseem, Stefan Günther
Publikováno v:
Journal of Chemical Information and Modeling. 61:5327-5330
While aromatic cages have extensively been investigated in the context of structural biology, molecular recognition, and drug discovery, there exist to date no comprehensive resource for proteins sharing this conserved structural motif. To this end,
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::1b1251e84e7dbda31a49624a8f02500f
https://doi.org/10.1021/acs.jcim.1c00927
https://doi.org/10.1021/acs.jcim.1c00927
Publikováno v:
Archiv der PharmazieREFERENCES. 356(1)
Host cell entry of severe acute respiratory syndrome coronavirus 2 (SARS-CoV-2) is facilitated via priming of its spike glycoprotein by the human transmembrane protease serine 2 (TMPRSS2). Although camostat and nafamostat are two highly potent covale
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::1872d8351465136cb89c7d1c8cb9cfcd
https://pubmed.ncbi.nlm.nih.gov/36316225
https://pubmed.ncbi.nlm.nih.gov/36316225
Publikováno v:
RSC Advances. 11:15060-15077
Cyperus rotundus L. (Nutgrass, family Cyperaceae) is a notorious weed which is widespread in temperate tropical and subtropical regions of the world. Owing to its richness and potent pharmacological activities, efforts have been devoted to identify i
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::39696a524c26eecb0867d688b75012a1
https://doi.org/10.1039/d1ra00478f
https://doi.org/10.1039/d1ra00478f
Publikováno v:
Journal of Chemical Information and Modeling. 60:5225-5233
Histone methylation reader proteins (HMRPs) regulate gene transcription by recognizing, at their "aromatic cage" domains, various Lys/Arg methylation states on histone tails. Because epigenetic dysregulation underlies a wide range of diseases, HMRPs
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::9c404d564e8d63b5889e8e9b55002c61
https://doi.org/10.1021/acs.jcim.0c00765
https://doi.org/10.1021/acs.jcim.0c00765
Autor:
Evelyn Lamy, Aurélien F. A. Moumbock, Henning J. Jessen, Jianyu Li, Hoai Thi Thu Tran, Rahel Hinkelmann, Stefan Günther
Publikováno v:
Journal of chemical information and modeling. 61(7)
Bioactive compounds oftentimes bind to several target proteins, thereby exhibiting polypharmacology. Experimentally determining these interactions is however laborious, and structure-based virtual screening (SBVS) of bioactive compounds could expedit
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::de0952577ddc035ab2fe06072b1751ca
https://pubmed.ncbi.nlm.nih.gov/34236848
https://pubmed.ncbi.nlm.nih.gov/34236848
Autor:
Paul F. Zierep, Randi Vita, Nina Blazeska, Aurélien F. A. Moumbock, Jason A. Greenbaum, Bjoern Peters, Stefan Günther
Publikováno v:
PLoS computational biology. 18(2)
In-silico methods for the prediction of epitopes can support and improve workflows for vaccine design, antibody production, and disease therapy. So far, the scope of B cell and T cell epitope prediction has been directed exclusively towards peptidic
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::b951eb42d5a27a0ea1025f360e418615
https://pubmed.ncbi.nlm.nih.gov/35180214
https://pubmed.ncbi.nlm.nih.gov/35180214
Autor:
Stefan Günther, Wolfgang Sippl, Ammar Qaseem, Kiran K. Telukunta, Conrad V. Simoben, Aurélien F. A. Moumbock, Fidele Ntie-Kang
Publikováno v:
Molecular Informatics
MOLECULAR INFORMATICS
MOLECULAR INFORMATICS
Medicinal plants have widely been used in the traditional treatment of ailments and have been proven effective. Their contribution still holds an important place in modern drug discovery due to their chemical, and biological diversities. However, the
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::af67f28406bbc3c540d19f15ed8fb9f6
http://europepmc.org/articles/PMC7685152
http://europepmc.org/articles/PMC7685152