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袁曙光 2017-10-12 13:27
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个人分类: 科研笔记|2065 次阅读|没有评论
Nobel Prize 2017 in Chemistry
袁曙光 2017-10-4 17:59
2017年诺贝尔奖被三位研究高分辨率冷冻电镜的科学家分享。 Jacques Dubochet, Joachim Frank and Richard Henderson win the 2017 Nobel prize in chemistry。 The citation reads that the trio scooped the prize “for developing cryo-electron microscopy for the high-resolution structure determination of b ...
2480 次阅读|没有评论
Designing Safer Analgesics via u-Opioid Receptor Pathways
袁曙光 2017-9-21 19:16
HCS Chan, D McCarthy, J Li, K Palczewski, S Yuan *. Trends in Pharmacological Science (2017) DOI: http://dx.doi.org/10.1016/j.tips.2017.08.004 Pain is both a major clinical and economic problem, affecting more people than diabetes, heart disease, and cancer combined. While a ...
个人分类: 科研笔记|2092 次阅读|没有评论
an improved force field for folded and disordered protein
袁曙光 2017-8-20 15:32
CHARMM36m: An Improved Force Field for Folded and Intrinsically Disordered Proteins. Nature Methods, 2017 Jan; 14(1): 71–73. doi: 10.1038/nmeth.4067 Disordered protein is a challenge for molecular dynamic simulations, especially considering the lack of a proper force field. In a rece ...
个人分类: 科研笔记|3088 次阅读|没有评论
Two postdoc positions
袁曙光 2017-8-16 22:32
Professor Jianing Li has an opening of a postdoctoral fellow in the Department of Chemistry at the University of Vermont (UVM). Candidates with a Ph.D. degree in Computational Chemistry or related fields, and a strong background in modeling biological and/or organic systems with programming experie ...
2181 次阅读|没有评论
A Postdoctoral Position - Peptide Chemistry and Drug Design
袁曙光 2017-7-28 17:27
Job description The Molecular Pharmacy group at the Pharmacenter of the University of Basel is looking for highly motivated candidates for a full-time postdoctoral position in peptide chemistry and drug design. The position is available starting in September 2017. Who we are: Our multi-disci ...
2113 次阅读|没有评论
Enantioselectivity of a Defluorinase
袁曙光 2017-7-28 17:22
J. Am. Chem. Soc. DOI: 10.1021/jacs.7b06019 Publication Date (Web): July 25, 2017 Jian-bo Wang, Adriana Ilie, Shuguang Yuan*, and Manfred T. Reetz* The possibility of a double Walden inversion mechanism of the fluoracetate dehalogenase FAcD (RPA1163) has been studied by subjecti ...
2069 次阅读|没有评论
China hits milestone in developing quantum computer
袁曙光 2017-5-3 17:50
High-efficiency multiphoton boson sampling Nature Photonics (2017) doi:10.1038/nphoton.2017.63 full text News Link Boson sampling is considered as a strong candidate to demonstrate ‘quantum computational supremacy’ over classical computers. However, previous proof-of- ...
2801 次阅读|没有评论
Martini Coarse-Graining Workshop 2017
袁曙光 2017-4-26 22:12
Where : University of Groningen, Groningen, The Netherlands: http://www.rug.nl/staff/location/5161 http://www.rug.nl/fse/organization/locaties http://www.zernikecampusgroningen.nl/download-plattegrond When : August 20-25, 2017. The workshop starts Sunday, August 20, 20:00 hou ...
个人分类: Linux相关|2498 次阅读|没有评论
Implementing WebGL and HTML5 in visualziation and CADD
袁曙光 2017-4-16 21:47
Web browsers have long been recognized as potential platforms for remote macromolecule visualization. However, the difficulty in transferring large-scale data to clients and the lack of native support for hardware-accelerated applications in the local browser undermine the feasibility ...
2117 次阅读|没有评论

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