Zobrazeno 1 - 10
of 15
pro vyhledávání: '"Fabian, Dey"'
Autor:
Maarten Vercruysse, Yimin Hu, Yunhua Xu, Hua Lv, Waikwong Wu, Fabian Dey, Tianyi Jiang, Xuefei Tan, Wen Wang, Ying Ji, Zhiheng Xu, Zhang Zhiwei, Yi Mao, Kenneth Bradley, Guanglei Zhai, Liu Yongqiang, Xiangyu Yao, Qingcheng Ren, Hong C. Shen, S. Frank Yan, Xiao Ding, Weixing Zhang, Xiaomin Yu, Shi Houguang, Zhu Wei, Chengang Zhou, Mingwei Zhou, Zheng Zhou
Publikováno v:
Journal of Medicinal Chemistry. 63:9623-9649
The rise of multidrug resistant (MDR) Gram-negative (GN) pathogens and the decline of available antibiotics that can effectively treat these severe infections are a major threat to modern medicine. Developing novel antibiotics against MDR GN pathogen
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::b7925b6d7c4055b2de9cff35400afc18
https://doi.org/10.1021/acs.jmedchem.0c00768
https://doi.org/10.1021/acs.jmedchem.0c00768
Autor:
Hong C. Shen, Zhu Wei, Zongxing Qiu, Hongxia Qiu, Sheng Zhong, Zheng Zhou, Weixing Zhang, Xue Zhou, Guozhi Tang, Fabian Dey, Guang Yang, Xianfeng Lin, Jianxun Xie, Shi Houguang
Publikováno v:
Journal of Medicinal Chemistry. 62:10352-10361
Described herein is a new approach to mitigate CYP3A4 induction. In this unconventional approach, a fine-tuning of the dihedral angle between the C4 phenyl and the dihydropyrimidine core of the heteroaryldihydropyrimidine (HAP) class of capsid inhibi
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::6b153ad80711313c03dde97212d3e426
https://doi.org/10.1021/acs.jmedchem.9b01421
https://doi.org/10.1021/acs.jmedchem.9b01421
Autor:
Yimin, Hu, Houguang, Shi, Mingwei, Zhou, Qingcheng, Ren, Wei, Zhu, Weixing, Zhang, Zhiwei, Zhang, Chengang, Zhou, Yongqiang, Liu, Xiao, Ding, Hong C, Shen, S Frank, Yan, Fabian, Dey, Waikwong, Wu, Guanglei, Zhai, Zheng, Zhou, Zhiheng, Xu, Ying, Ji, Hua, Lv, Tianyi, Jiang, Wen, Wang, Yunhua, Xu, Maarten, Vercruysse, Xiangyu, Yao, Yi, Mao, Xiaomin, Yu, Kenneth, Bradley, Xuefei, Tan
Publikováno v:
Journal of medicinal chemistry. 63(17)
The rise of multidrug resistant (MDR) Gram-negative (GN) pathogens and the decline of available antibiotics that can effectively treat these severe infections are a major threat to modern medicine. Developing novel antibiotics against MDR GN pathogen
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=pmid________::1733146a8e74a53cff12cfb8099586eb
https://pubmed.ncbi.nlm.nih.gov/32787097
https://pubmed.ncbi.nlm.nih.gov/32787097
Autor:
Yibing Wu, Marco Punta, Rong Xiao, Thomas B Acton, Bharathwaj Sathyamoorthy, Fabian Dey, Markus Fischer, Arne Skerra, Burkhard Rost, Gaetano T Montelione, Thomas Szyperski
Publikováno v:
PLoS ONE, Vol 7, Iss 6, p e37404 (2012)
The soluble monomeric domain of lipoprotein YxeF from the Gram positive bacterium B. subtilis was selected by the Northeast Structural Genomics Consortium (NESG) as a target of a biomedical theme project focusing on the structure determination of the
Externí odkaz:
https://doaj.org/article/75854a80aed04bf4a7b9adb71cf253d4
Publikováno v:
Proceedings of the National Academy of Sciences of the United States of America. 114(52)
We report a template-based method, LT-scanner, which scans the human proteome using protein structural alignment to identify proteins that are likely to bind ligands that are present in experimentally determined complexes. A scoring function that rap
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::74b4791ec67139c6728b41e8fe3ac764
https://pubmed.ncbi.nlm.nih.gov/29229851
https://pubmed.ncbi.nlm.nih.gov/29229851
Autor:
Fabian Dey, Andreas Schoop
Publikováno v:
Drug Discovery Today: Technologies. 17:9-15
In the lead discovery process residence time has become an important parameter for the identification and characterization of the most efficacious compounds in vivo. To enable the success of compound optimization by medicinal chemistry toward a desir
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::10f9e3d58bb7ed53a7e27dac8f150aa7
https://doi.org/10.1016/j.ddtec.2015.08.003
https://doi.org/10.1016/j.ddtec.2015.08.003
Publikováno v:
Protein Science. 22:359-366
We outline a set of strategies to infer protein function from structure. The overall approach depends on extensive use of homology modeling, the exploitation of a wide range of global and local geometric relationships between protein structures and t
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::2bbb9160011a5b251e85ef768903e3e9
https://doi.org/10.1002/pro.2225
https://doi.org/10.1002/pro.2225
Publikováno v:
Journal of Medicinal Chemistry. 51:1179-1188
The linear interaction energy method with continuum electrostatics (LIECE) is evaluated in depth on five kinases. The two multiplicative coefficients for the van der Waals energy and electrostatic free energy are shown to be transferable among differ
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::54c0b6e53229f497fe78973e842781f9
https://doi.org/10.1021/jm070654j
https://doi.org/10.1021/jm070654j
Autor:
Marco Punta, Rong Xiao, Markus Fischer, Bharathwaj Sathyamoorthy, Fabian Dey, Yibing Wu, Thomas Szyperski, Thomas Acton, Arne Skerra, Gaetano T. Montelione, Burkhard Rost
Publikováno v:
PLoS ONE
PLoS ONE, Vol 7, Iss 6, p e37404 (2012)
PLoS ONE, Vol 7, Iss 6, p e37404 (2012)
The soluble monomeric domain of lipoprotein YxeF from the Gram positive bacterium B. subtilis was selected by the Northeast Structural Genomics Consortium (NESG) as a target of a biomedical theme project focusing on the structure determination of the
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::60ee4c87643515181a71a92ed57b3fea
https://pubmed.ncbi.nlm.nih.gov/22693626
https://pubmed.ncbi.nlm.nih.gov/22693626
Publikováno v:
Nucleic Acids Research
We describe MarkUs, a web server for analysis and comparison of the structural and functional properties of proteins. In contrast to a 'structure in/function out' approach to protein function annotation, the server is designed to be highly interactiv
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::c9c21de8b95c042068b2da73309cb39d
https://pubmed.ncbi.nlm.nih.gov/21672961
https://pubmed.ncbi.nlm.nih.gov/21672961