排序方式: 共有37条查询结果,搜索用时 15 毫秒
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双核系统核子转移驱动势与复合核的最佳激发能 总被引:2,自引:1,他引:1
计算了以208Pb为靶的一系列重离子熔合反应双核系统核子转移驱动势.它制约由输运方程所支配的核子转移速率,因而确定了双核系统形成复合核的几率.并由此可确定形成复合核所必须的最低激发能,即形成最稳定复合核的最佳激发能,得到了与已知实验值基本符合的结果. Particle transfer driven potentials in Di nuclear System (DNS) in heavy ion collisions based on 208Pb target are calculated. The driven potential controls the particle transfer velocity in the process governed by the diffusion equation, and as a consequence determines the compound nuclear formation probability of DNS. The minimum excitation energy to form a compound nucleus, which is the optimum excitation energy to form the most stable compound nucleus, has been calculated, and the results are basica... 相似文献
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Chengwei Deng 《中国物理 B》2022,31(11):118702-118702
RNAs play crucial and versatile roles in cellular biochemical reactions. Since experimental approaches of determining their three-dimensional (3D) structures are costly and less efficient, it is greatly advantageous to develop computational methods to predict RNA 3D structures. For these methods, designing a model or scoring function for structure quality assessment is an essential step but this step poses challenges. In this study, we designed and trained a deep learning model to tackle this problem. The model was based on a graph convolutional network (GCN) and named RNAGCN. The model provided a natural way of representing RNA structures, avoided complex algorithms to preserve atomic rotational equivalence, and was capable of extracting features automatically out of structural patterns. Testing results on two datasets convincingly demonstrated that RNAGCN performs similarly to or better than four leading scoring functions. Our approach provides an alternative way of RNA tertiary structure assessment and may facilitate RNA structure predictions. RNAGCN can be downloaded from https://gitee.com/dcw-RNAGCN/rnagcn. 相似文献
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腺苷酸激酶是一个包含三个结构域(LID结构域、NMP结构域和CORE结构域)的蛋白质分子,其主要作用是催化化学反应Mg2+ + ATP + AMP ⇌ 2ADP + Mg2+,进而将细胞内ATP分子的浓度维持在合适的范围内。在腺苷酸激酶催化上述化学反应的过程中,需要有Mg2+的参与。最近的实验发现Mg2+不仅参与上述反应的化学步骤,而且对化学反应发生后底物的释放过程至关重要。已有晶体结构数据显示,在催化循环过程的化学反应步骤完成后,一个Mg2+可同时和分别位于LID结构域及NMP结构域的两个ADP分子配位。然而,在底物的释放与分离过程中, Mg2+可能只与其中一个ADP分子结合。由于Mg2+与ADP分子的结合情况会在很大程度上影响作为催化循环限速步骤的底物释放过程,因此人们有必要研究清楚在底物释放前Mg2+与催化产物ADP分子的配位情况,即Mg2+更倾向于与LID结构域的ADP分子结合还是与NMP结构域的ADP分子结合。本文中,我们对催化反应后底物释放前的酶-底物复合物(包含酶、两个ADP分子以及Mg2+)做了分子动力学模拟研究。我们基于metadynamics方法得到了Mg2+在两个ADP分子间转移的自由能面,发现在底物分离与释放过程中, Mg2+更倾向于与LID结构域的ADP分子结合。只有当LID结构域的ADP分子被质子化,同时NMP结构域的ADP分子处于去质子化状态时, Mg2+才会倾向于与NMP结构域的ADP分子结合。另外,我们也刻画了Mg2+转移过程中配体交换与脱水过程。本工作的研究结果有助于理解腺苷酸激酶催化循环后期的分子过程。 相似文献
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基于GEANT4模拟了HIRFL CSRm内靶实验终端的CsI(Tl)电磁量能器系统,给出了CsI电磁量能器的最佳设计参数及可能达到的性能.结果表明,设计的CsI(Tl)电磁量能器系统能够满足所研究的物理要求. Based on the GEANT4, the performance of the electromagnetic calorimeter (EMC) of the internal-target detector at HIRFL-CSRm is simulated. The simulation results show that 1.5%—3% of the energy resolution σ_E/E and 2° of the polar angular resolution σ_θ can be obtained. The invariant mass of the π~0 decay can be reconstructed well. The performance can meet the requirement of studying the proposed physics at HIRFL-CSRm. 相似文献
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以正硅酸乙酯(TEOS)为硅源,采用溶胶-凝胶法制备一系列非均相多钼氧簇催化剂(PMoO/SiO_2)。通过FT-IR、XRD、SEM等对其结构加以表征。以过氧化氢为氧化剂、PMoO/SiO_2为催化剂,研究PMoO/SiO_2的负载量、反应温度、pH对催化活性的影响,利用计算机模拟揭示多钼氧簇与二氧化硅之间的相互作用。研究表明:催化剂PMoO/SiO_2在负载量为25%、反应温度45℃、pH=1.4条件下碘离子的氧化反应速率为9.25×10~(-5)mol/(L*s),与未添加催化剂相比,PMoO/SiO_2的催化效果提高6.85×10~3倍。PMoO倾向于物理吸附在不定形SiO_2的富Si面,同时以形成O-H键和O-Si键的形式发生化学相互作用,使得电子从不定形SiO_2向PMoO表面转移,发生协同催化作用。催化剂在循环使用十次之后催化碘离子转化率仍高达86.5%,循环使用性好,无过氧化,具有较好的工业应用前景。 相似文献
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γ射线与晶体单元的相互作用特性对于PET探测器的研制有着重要的参考意义. 通过实验测得了不同能量的γ射线在BGO, CsI, NaI 3种闪烁晶体中的探测效率、 能量分辨率等相互作用特性参数, 并与蒙特卡洛模拟结果进行了比较. 结果给出了最适合PET探测器的晶体单元. It’s important for development of PET detector that the interaction effect of γ rays and scintillator units are studied. The detection efficiencies and energy resolutions of γ rays for BGO, CsI and NaI crystal detector units are measured. Geant4 Monte Carlo simulations are compared with the experimental results. The results of the best detection units for PET detector are presented. 相似文献
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Entrance Channel Dependence of Production Cross Sections of Superheavy Nuclei in Cold Fusion Reactions 下载免费PDF全文
Production cross sections of superheavy nuclei Rf and Hs for asymmetric and nearly symmetric projectile-target combinations are systematically studied within the framework of the dinuclear system model. The calculated results show that the production cross sections are strongly dependent on the symmetry of reaction systems. The obtained results are in good agreement with the available experimental data for asymmetric reaction systems.For nearly symmetric systems, the model gives opposite results with coupled channel model in which surface vibration and nucleon transfer are included. 相似文献