日期 影响因子
日期:
2020 年 — 2026 年
2020
2021
2022
2023
2024
2025
2026
影响因子:
–

Exploration of Agonist and Antagonist Binding Sites within the Cytosolic AHR Complex Using Molecular Modeling

利用分子建模探索胞质AHR复合物中的激动剂和拮抗剂结合位点

期刊:ACS Omega
影响因子:4.3
doi:10.1021/acsomega.5c10598
Karabogdan, Ivana; Yanqui-Rivera, Francisco; Sayeeram, Deepak; Sadik, Ahmed; Miller, Aubry K; Trump, Saskia; Röhrig, Ute F; Opitz, Christiane A
AHR
发表日期：2026
文献求助 收藏

Hybrid quantum/classical docking of covalent and non-covalent ligands with Attracting Cavities

利用吸引空腔对共价和非共价配体进行混合量子/经典对接

期刊:Scientific Reports
影响因子:3.9
doi:10.1038/s41598-025-24614-3
Goullieux, Mathilde; Zoete, Vincent; Röhrig, Ute F
发表日期：2025
文献求助 收藏

SwissDock 2024: major enhancements for small-molecule docking with Attracting Cavities and AutoDock Vina

SwissDock 2024：通过吸引腔和 AutoDock Vina 对小分子对接进行重大改进

期刊:Nucleic Acids Research
影响因子:13.1
doi:10.1093/nar/gkae300
Bugnon, Marine; Röhrig, Ute F; Goullieux, Mathilde; Perez, Marta A S; Daina, Antoine; Michielin, Olivier; Zoete, Vincent
发表日期：2024
文献求助 收藏

Two-Step Covalent Docking with Attracting Cavities

利用吸引空腔的两步共价对接

期刊:Journal of Chemical Information and Modeling
影响因子:5.3
doi:10.1021/acs.jcim.3c01055
Goullieux, Mathilde; Zoete, Vincent; Röhrig, Ute F
发表日期：2023
文献求助 收藏

SwissParam 2023: A Modern Web-Based Tool for Efficient Small Molecule Parametrization

SwissParam 2023：一款用于高效小分子参数化的现代化网络工具

期刊:Journal of Chemical Information and Modeling
影响因子:5.3
doi:10.1021/acs.jcim.3c01053
Bugnon, Marine; Goullieux, Mathilde; Röhrig, Ute F; Perez, Marta A S; Daina, Antoine; Michielin, Olivier; Zoete, Vincent
发表日期：2023
文献求助 收藏

Attracting Cavities 2.0: Improving the Flexibility and Robustness for Small-Molecule Docking

吸引腔体 2.0：提高小分子对接的灵活性和鲁棒性

期刊:Journal of Chemical Information and Modeling
影响因子:5.3
doi:10.1021/acs.jcim.3c00054
Röhrig, Ute F; Goullieux, Mathilde; Bugnon, Marine; Zoete, Vincent
发表日期：2023
文献求助 收藏

The conserved threonine-rich region of the HCF-1PRO repeat activates promiscuous OGT:UDP-GlcNAc glycosylation and proteolysis activities

HCF-1PRO 重复序列中保守的富含苏氨酸的区域可激活混杂的 OGT:UDP-GlcNAc 糖基化和蛋白水解活性

期刊:Journal of Biological Chemistry
影响因子:4
doi:10.1074/jbc.RA118.004185
Vaibhav Kapuria, Ute F Röhrig, Patrice Waridel, Fabienne Lammers, Vladimir S Borodkin, Daan M F van Aalten, Vincent Zoete, Winship Herr
信号转导
FCM
IF
IHC-P
WB
发表日期：2018
文献求助 收藏

Attracting cavities for docking. Replacing the rough energy landscape of the protein by a smooth attracting landscape

吸引空腔用于对接。用平滑的吸引势能面取代蛋白质粗糙的能量势能面。

期刊:Journal of Computational Chemistry
影响因子:4.8
doi:10.1002/jcc.24249
Zoete, Vincent; Schuepbach, Thierry; Bovigny, Christophe; Chaskar, Prasad; Daina, Antoine; Röhrig, Ute F; Michielin, Olivier
发表日期：2016
文献求助 收藏

Proteolysis of HCF-1 by Ser/Thr glycosylation-incompetent O-GlcNAc transferase:UDP-GlcNAc complexes

通过 Ser/Thr 糖基化缺陷的 O-GlcNAc 转移酶：UDP-GlcNAc 复合物对 HCF-1 进行蛋白水解

期刊:Genes & Development
影响因子:1.9
doi:10.1101/gad.275925.115
Vaibhav Kapuria, Ute F Röhrig, Tanja Bhuiyan, Vladimir S Borodkin, Daan M F van Aalten, Vincent Zoete, Winship Herr
信号转导
FCM
IF
IHC-P
WB
发表日期：2016
文献求助 收藏

Single amino acid charge switch defines clinically distinct proline-serine-threonine phosphatase-interacting protein 1 (PSTPIP1)-associated inflammatory diseases

单氨基酸电荷转换定义了临床上不同的脯氨酸-丝氨酸-苏氨酸磷酸酶相互作用蛋白 1 (PSTPIP1) 相关炎症疾病

期刊:Journal of Allergy and Clinical Immunology
影响因子:11.4
doi:10.1016/j.jaci.2015.04.016
Dirk Holzinger, Selina Kathleen Fassl, Wilco de Jager, Peter Lohse, Ute F Röhrig, Marco Gattorno, Alessia Omenetti, Sabrina Chiesa, Francesca Schena, Judith Austermann, Thomas Vogl, Douglas B Kuhns, Steven M Holland, Carlos Rodríguez-Gallego, Ricardo López-Almaraz, Juan I Arostegui, Elena Colino, Ro
免疫
发表日期：2015
文献求助 收藏