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publications [2021/05/03 03:49]
xfel [2021]
publications [2021/09/07 09:59] (current)
xfel [2021]
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 ====2021==== ====2021====
-    -Abdullahi Ibrahim Uba, Nicolas Scorese, Emily Dean, **Haiguang Liu\***, and Chun Wu*, Activation Mechanism of Corticotrophin Releasing Factor Receptor Type 1 Elucidated Using Molecular Dynamics Simulations. ACS Chem. Neurosci. 2021 https://​pubs.acs.org/​doi/​abs/​10.1021/​acschemneuro.1c00126 +    ​-Liang Tian, Xuefei Li, Fei Qi,  Qian-Yuan Tang, Viola, ​ Tang, Jiang Liu,  Zhiyuan Li, Xingye Cheng, Xuanxuan Li,  Yingchen Shi,  **Haiguang Liu**, Lei-Han Tang*. Harnessing peak transmission around symptom onset for non-pharmaceutical intervention and containment of the COVID-19 pandemic, **Nature Communications**,​ 12, 1-12 (2021) 
-    -Ji-Hye Yun#, Xuanxuan Li#, Jianing Yue, Jae-Hyun Park, Zeyu Jin, Chufeng Li, Hao Hu, Yingchen Shi, Suraj Pandey, Sergio Carbajo, Sébastien Boutet, Mark S. Hunter, Mengning Liang, Raymond G. Sierra, Thomas J. Lane, Liang Zhou, Uwe Weierstall, Nadia A. Zatsepin, Mio Ohki, Jeremy R. H. Tame, Sam-Yong Park, John C. H. Spence, Wenkai Zhang, ​*Marius Schmidt*, Weontae Lee*, **Haiguang Liu\***, Early-stage dynamics of chloride ion–pumping rhodopsin revealed by a femtosecond X-ray laser. Proceedings of the National Academy of Sciences Mar 2021, 118 (13) e2020486118;​ DOI: 10.1073/​pnas.2020486118 https://​www.pnas.org/​content/​118/​13/​e2020486118 +    - Vikash Kumar, **Haiguang Liu**, Chun Wu*, Drug repurposing against SARS-CoV-2 receptor binding domain using ensemble-based virtual screening and molecular dynamics simulations,​ **Computers in biology and medicine**, 135, 104634 (2021) ​   
-    -Chun-Yan Liu, Lupala Cecylia Severin, Chang-Jiang Lyu, Wan-Li Zhu, Hong-Peng Wang, Cheng-Jun Jiang, Le-He Mei, **Hai-Guang Liu***, Jun Huang*, Improving thermostability of (R)-selective amine transaminase from Aspergillus terreus by evolutionary coupling saturation mutagenesis,​ +    - Cecylia S. Lupala, Xuanxuan Li, Jian Lei, Hong Chen, Jianxun Qi, **Haiguang Liu***, Xiao-Dong Su*, Computational simulations reveal the binding dynamics between human ACE2 and the receptor binding domain of SARS-CoV-2 spike protein, **Quantitative Biology**, 2021, 9(1): 61-72. (Cover Article) https://​journal.hep.com.cn/​qb/​article/​2021/​2095-4689/​28794 
-Biochemical Engineering Journal, 167,107926 (2021) https://​doi.org/​10.1016/​j.bej.2021.107926.+    ​-Abdullahi Ibrahim Uba, Nicolas Scorese, Emily Dean, **Haiguang Liu***, and Chun Wu*, Activation Mechanism of Corticotrophin Releasing Factor Receptor Type 1 Elucidated Using Molecular Dynamics Simulations. ​**ACS Chem. Neurosci.** 2021 https://​pubs.acs.org/​doi/​abs/​10.1021/​acschemneuro.1c00126 
 +    -Ji-Hye Yun#, Xuanxuan Li#, Jianing Yue, Jae-Hyun Park, Zeyu Jin, Chufeng Li, Hao Hu, Yingchen Shi, Suraj Pandey, Sergio Carbajo, Sébastien Boutet, Mark S. Hunter, Mengning Liang, Raymond G. Sierra, Thomas J. Lane, Liang Zhou, Uwe Weierstall, Nadia A. Zatsepin, Mio Ohki, Jeremy R. H. Tame, Sam-Yong Park, John C. H. Spence, Wenkai Zhang, Marius Schmidt*, Weontae Lee*, **Haiguang Liu***, Early-stage dynamics of chloride ion–pumping rhodopsin revealed by a femtosecond X-ray laser. ​**Proceedings of the National Academy of Sciences** Mar 2021, 118 (13) e2020486118;​ DOI: 10.1073/​pnas.2020486118 https://​www.pnas.org/​content/​118/​13/​e2020486118 
 +    -Chun-Yan Liu, Lupala Cecylia Severin, Chang-Jiang Lyu, Wan-Li Zhu, Hong-Peng Wang, Cheng-Jun Jiang, Le-He Mei, **Hai-Guang Liu***, Jun Huang*, Improving thermostability of (R)-selective amine transaminase from Aspergillus terreus by evolutionary coupling saturation mutagenesis, ​**Biochemical Engineering Journal**, 167,107926 (2021) https://​doi.org/​10.1016/​j.bej.2021.107926.
  
 ====2020==== ====2020====

Richard Feynman

“everything that is living can be understood in terms of the jiggling and wiggling of atoms”.

and now, we want to watch atoms jiggling and wiggling.

X-rays, electrons, fluorescence light, the advances of photon sciences, together with computational modeling, are making this happen.