Younan Xia

Bio: Younan Xia is an academic researcher from The Wallace H. Coulter Department of Biomedical Engineering. The author has contributed to research in topics: Nanocages & Nanowire. The author has an hindex of 216, co-authored 943 publications receiving 175757 citations. Previous affiliations of Younan Xia include Washington University in St. Louis & University of Texas at Dallas.

New development of nonlinear optical crystals for the ultraviolet region with molecular engineering approach

Abstract: Potassium fluoroboratoberyllate KBe2BO3F2 (KBBF) has been revealed theoretically and experimentally as a novel ultraviolet nonlinear optical crystal, but it is found to be very difficult to grow in a large size, because of the weak binding interaction between the (Be2BO3)∞ units, which leads to an apparent layer habit in the growth. By using a molecular engineering approach, oxygen bridges when brought in to strengthen the binding between the infinite units are found to be useful to overcome the above shortcoming of KBBF, and in the light of it another new ultraviolet nonlinear optical crystal—strontium boratoberyllate Sr2Be2B2O7 (SBBO) has been discovered. The linear optical properties of SBBO are similar to KBBF’s, but its nonlinear optical properties are better than that of the latter. d22(SBBO)≂d22(β‐BaB2O4), which is two times higher than d11 of KBBF. SBBO has very good mechanical properties, and it is also not deliquescent. So SBBO is expected to have great potential for the application in ultraviol...

Fast parallel algorithms for short-range molecular dynamics

Abstract: Three parallel algorithms for classical molecular dynamics are presented. The first assigns each processor a fixed subset of atoms; the second assigns each a fixed subset of inter-atomic forces to compute; the third assigns each a fixed spatial region. The algorithms are suitable for molecular dynamics models which can be difficult to parallelize efficiently—those with short-range forces where the neighbors of each atom change rapidly. They can be implemented on any distributed-memory parallel machine which allows for message-passing of data between independently executing processors. The algorithms are tested on a standard Lennard-Jones benchmark problem for system sizes ranging from 500 to 100,000,000 atoms on several parallel supercomputers--the nCUBE 2, Intel iPSC/860 and Paragon, and Cray T3D. Comparing the results to the fastest reported vectorized Cray Y-MP and C90 algorithm shows that the current generation of parallel machines is competitive with conventional vector supercomputers even for small problems. For large problems, the spatial algorithm achieves parallel efficiencies of 90% and a 1840-node Intel Paragon performs up to 165 faster than a single Cray C9O processor. Trade-offs between the three algorithms and guidelines for adapting them to more complex molecular dynamics simulations are also discussed.

疟原虫var基因转换速率变化导致抗原变异[英]／Paul H, Robert P, Christodoulou Z, et al//Proc Natl Acad Sci U S A

Abstract: 抗原变异可使得多种致病微生物易于逃避宿主免疫应答。表达在感染红细胞表面的恶性疟原虫红细胞表面蛋白1（PfPMP1）与感染红细胞、内皮细胞、树突状细胞以及胎盘的单个或多个受体作用，在黏附及免疫逃避中起关键的作用。每个单倍体基因组var基因家族编码约60种成员，通过启动转录不同的var基因变异体为抗原变异提供了分子基础。

Gold nanoparticles: assembly, supramolecular chemistry, quantum-size-related properties, and applications toward biology, catalysis, and nanotechnology.

Abstract: Although gold is the subject of one of the most ancient themes of investigation in science, its renaissance now leads to an exponentially increasing number of publications, especially in the context of emerging nanoscience and nanotechnology with nanoparticles and self-assembled monolayers (SAMs). We will limit the present review to gold nanoparticles (AuNPs), also called gold colloids. AuNPs are the most stable metal nanoparticles, and they present fascinating aspects such as their assembly of multiple types involving materials science, the behavior of the individual particles, size-related electronic, magnetic and optical properties (quantum size effect), and their applications to catalysis and biology. Their promises are in these fields as well as in the bottom-up approach of nanotechnology, and they will be key materials and building block in the 21st century. Whereas the extraction of gold started in the 5th millennium B.C. near Varna (Bulgaria) and reached 10 tons per year in Egypt around 1200-1300 B.C. when the marvelous statue of Touthankamon was constructed, it is probable that “soluble” gold appeared around the 5th or 4th century B.C. in Egypt and China. In antiquity, materials were used in an ecological sense for both aesthetic and curative purposes. Colloidal gold was used to make ruby glass 293 Chem. Rev. 2004, 104, 293−346