基序B参与调控模板依赖的聚合酶抑制作用

RNA依赖的RNA聚合酶是参与新冠病毒进行RNA复制与转录的主要分子机器. 之前的实验研究表明瑞德西韦在模板链上时存在两次抑制作用,即不仅可以抑制与之互补的尿嘧啶核苷三磷酸的加成,还可以抑制下一位核苷三磷酸的加成. 然而,第二次抑制作用的分子机制尚未阐明. 本文运用了分子动力学模拟,发现瑞德西韦在模板链上的第二次抑制不是直接作用于核苷酸在活性位点的加成,而是源于瑞德西韦从+1位点到-1位点的迁移过程受到阻碍,这将导致活性位点无法空出,核苷三磷酸无法进入活性位点从而产物链的延长被终止. 首先,发现了基序B中G683会和瑞德西韦的1''-氰基相互作用,导致移位后态的RNA双链配对稳定性低于移位前态,从而使得瑞德西韦的移位在热力学上不易发生. 其次,由于瑞德西韦的1''-氰基在迁移过程中会与基序B的S682产生位阻,进一步从动力学上阻碍了瑞德西韦动态移位的发生. 本研究不仅揭示了基序B上两个相邻且高度保守的氨基酸可以调控瑞德西韦沿模板链的移位过程,同时,本文的发现也进一步完善了对瑞德西韦抑制新冠病毒RNA复制和转录的分子机制的理解.     

Discrete Boltzmann Method with Maxwell-Type Boundary Condition for Slip Flow

The rarefied effect of gas flow in microchannel is significant and cannot be well described by traditional hydrodynamic models. It has been known that discrete Boltzmann model(DBM) has the potential to investigate flows in a relatively wider range of Knudsen number because of its intrinsic kinetic nature inherited from Boltzmann equation.It is crucial to have a proper kinetic boundary condition for DBM to capture the velocity slip and the flow characteristics in the Knudsen layer. In this paper, we present a DBM combined with Maxwell-type boundary condition model for slip flow. The tangential momentum accommodation coefficient is introduced to implement a gas-surface interaction model.Both the velocity slip and the Knudsen layer under various Knudsen numbers and accommodation coefficients can be well described. Two kinds of slip flows, including Couette flow and Poiseuille flow, are simulated to verify the model.To dynamically compare results from different models, the relation between the definition of Knudsen number in hard sphere model and that in BGK model is clarified.     

Effect of biaxial strain and hydrostatic pressure on the magnetic properties of bilayer CrI3

Two-dimensional van der Waals magnetic materials are intriguing for applications in the future spintronics devices, so it is crucial to explore strategy to control the magnetic properties. Here, we carried out first-principles calculations and Monte Carlo simulations to investigate the effect of biaxial strain and hydrostatic pressure on the magnetic properties of the bilayer CrI₃. We found that the magnetic anisotropy, intralayer and interlayer exchange interactions, and Curie temperature can be tuned by biaxial strain and hydrostatic pressure. Large compressive biaxial strain may induce a ferromagneticto-antiferromagnetic transition of both CrI₃ layers. The hydrostatic pressure could enhance the intralayer exchange interaction significantly and hence largely boost the Curie temperature. The effect of the biaxial strain and hydrostatic pressure revealed in the bilayer CrI₃ may be generalized to other two-dimensional magnetic materials.     

用并行扫描方法开展的表面等离激元电子能谱成像

本文报道了高定向热解石墨上银纳米结构表面等离激元的电子能谱成像研究. 本文利用现有扫描探针电子能谱仪的角度色散特性,发展了一种多道测量模式. 通过沿一个方向扫描,可以并行获得银纳米结构表面等离激元电子能谱的二维分布. 实验确定的能谱成像空间分辨为80 nm左右.     

多维耦合受迫量子谐振子的普遍解

运用广义线性量子变换的普遍理论求解多维耦合受迫量子谐振子，给出了系统演化算符的矩阵元、波函数、力学量期望值和配分函数的严格表达式. 关键词： 多维耦合受迫量子谐振子 演化算符矩阵元 配分函数     

电子束辐照烟气脱硫脱氮反应器中的剂量分布的模拟计算

采用Monte-Carlo程序EGSnrcMP对能量为0.8MeV的电子束辐照烟气脱硫脱硝反应器中的剂量分布进行了模拟计算,将计算的结果运用MATLAB数学分析软件进行了数据处理,对能量为0.5MeV的电子束辐照烟气脱硫脱硝反应器中的剂量分布进行了模拟计算,并与文献中实验测量值进行了比较。结果表明:采用EGSnrcMP程序计算所得到的剂量与实验结果吻合。     

Deep level transient spectroscopy investigation of deep levels in CdS/CdTe thin film solar cells with Te:Cu back contact

Deep levels in Cds/CdTe thin film solar cells have a potent influence on the electrical property of these devices. As an essential layer in the solar cell device structure, back contact is believed to induce some deep defects in the CdTe thin film. With the help of deep level transient spectroscopy (DLTS), we study the deep levels in CdS/CdTe thin film solar cells with Te:Cu back contact. One hole trap and one electron trap are observed. The hole trap H1, localized at E_v+0.128~eV, originates from the vacancy of Cd (V_Cd. The electron trap E1, found at E_c-0.178~eV, is considered to be correlated with the interstitial Cu_i⁼ in CdTe.     

彩色负片印片颗粒指数的准确测定

分析了彩色负片印片颗粒指数σper实际测试中不同性能负片的测试特点和影响因素。印片颗粒指数的测试点应根据彩色负片的感光特性确定,为正常扩印时对应正片0．74中灰密度的负片密度点。影响印片颗粒指数值的两个主要因素是彩色相纸的反差修正系数α和彩色负片的覆盖力系数ECP;建立了α和ECP的实验求取方法,并通过对几种负片参量的实际测定,分析和说明了参量变化对印片颗粒指数数值的影响程度和应进行的修正。     

Coherent beam combination of adaptive fiber laser array with tilt-tip and phase-locking control

We present an experimental study on tilt-tip(TT) and phase-locking(PL) control in a coherent beam combination(CBC) system of adaptive fiber laser array.The TT control is performed using the adaptive fiber-optics collimator(AFOC),and the PL control is realized by the phase modulator(PM).Cascaded and simultaneous controls of TT and PL using stochastic parallel gradient descent(SPGD) algorithm are investigated in this paper.Two-fiber-laser-,four-fiber-laser-,and six-fiber-laser-arrays are employed to study the TT and PL control.In the cascaded control system,only one high-speed CMOS camera is used to collect beam data and a computer is used as the controller.In a simultaneous control system one high-speed CMOS camera and one photonic detector(PD) are employed,and a computer and a control circuit based on field programmable gate array(FPGA) are used as the controllers.Experimental results reveal that both cascaded and simultaneous controls of TT using AFOC and PL using PM in fiber laser array are feasible and effective.Cascaded control is more effective in static control situation and simultaneous control can be applied to the dynamic control system directly.The control signals of simultaneous PL and TT disturb each other obviously and TT and PL control may compete with each other,so the control effect is limited.     

一种测量物质折射率的新方法—Eu3+离子发射光谱法

本文提出一种利用Eu3+离子发射光谱来测定物质析射率的方法,使可测对象不仅限于晶体和玻璃,而且扩展到粉末样品.用此方法检验几种已知析射率的材料,都得到较好的符合.