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分子对接 2

分子成像 2

分子设计 2

分子诊断 2

合成 2

定点突变 2

灵活性 2

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ATP荧光检测 1

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SNP基因分型芯片 1

circRNA 1

不确定性 1

丝孢堆黑粉菌 1

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Effect of succinic acid deamidation-induced modification on wheat gluten

Lan LIAO, Mouming ZHAO, Haifeng ZHAO, Jiaoyan REN, Chun CUI, Xiao HU,

《化学科学与工程前沿（英文）》 2009年第3卷第4期页码 386-392 doi: 10.1007/s11705-009-0250-1

摘要： The effect of succinic acid deamidation-induced modification on wheat gluten was investigated in the present study. The changes of surface hydrophobicity, functional properties, secondary structure, and sensibility of proteolysis of modified samples were determined. The solubility of deamidated proteins increased in the isoelectric region of untreated wheat gluten. The isoelectric point of succinic acid deamidated wheat gluten was shifted to a basic pH and existed in the broad pH regions. Foaming property and molecular flexibility of wheat gluten were improved after the modification. The hydrolysis degree of the hydrolysates in proteolysis with flavorzyme and pancreatin increased after succinic acid deamidation. Moreover, succinic acid deamidation-induced modification resulted in little change in molecular weight and secondary structure of the protein. Thus, succinic acid could facilitate unfolding protein conformation. In addition, it could improve protein-water interactions, surface properties, and sensibility of the proteolysis of the deamidated wheat gluten.

关键词： pH isoelectric conformation deamidation-induced modification molecular flexibility

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工程承包联营体的柔性分析与评价

赵振宇,殷音

《中国工程科学》 2008年第10卷第9期页码 84-87

摘要：

讨论了工程承包联营体环境动荡性评价指标和工程承包联营体柔性评价指标以及相应的评价方法。通过柔性分析，可以判断出工程承包联营体各方面的柔性程度能否与其相应的环境和内外部因素相适应，并为制订调整联营体柔性度的措施提供帮助，进而提高联营体的管理水平和竞争力。

关键词：工程项目承包商联营体柔性管理

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Response in piled raft foundation of tall chimneys under along-wind load incorporating flexibility of

B. R. JAYALEKSHMI,S.V. JISHA,R. SHIVASHANKAR

《结构与土木工程前沿（英文）》 2015年第9卷第3期页码 307-322 doi: 10.1007/s11709-015-0288-8

摘要： The present paper deals with the numerical analysis of tall reinforced concrete chimneys with piled raft foundation subjected to along-wind loads considering the flexibility of soil. The analysis was carried out using finite element method on the basis of direct method of soil-structure interaction (SSI). The linear elastic material behavior was assumed for chimney, piled raft and soil. Four different material properties of soil stratum were selected in order to study the effect of SSI. The chimney elevation and the thickness of raft of piled raft foundation were also varied for the parametric study. The chimneys were assumed to be located in terrain category 2 and subjected to a maximum wind speed of 50 m/s as per IS:875 (Part 3)-1987. The along-wind loads were computed according to IS:4998 (Part 1)-1992. The base moments of chimney evaluated from the SSI analysis were compared with those obtained as per IS:4998 (Part 1)-1992. The tangential and radial bending moments of raft of piled raft foundation were evaluated through SSI analysis and compared with those obtained from conventional analysis as per IS:11089-1984, assuming rigidity at the base of the raft foundation. The settlements of raft of piled raft foundation, deflection of pile and moments of the pile due to interaction with different soil stratum were also evaluated. From the analysis, considerable reduction in the base moment of chimney due to the effect of SSI is observed. Higher radial moments and lower tangential moments were obtained for lower elevation chimneys with piled raft resting on loose sand when compared with conventional analysis results. The effect of SSI in the response of the pile is more significant when the structure-foundation system interacts with loose sand.

关键词： finite element method piled raft tall chimney soil-structure interaction along-wind load

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Review of

Yang YU, Jiafu TANG

《工程管理前沿（英文）》 2019年第6卷第2期页码 183-192 doi: 10.1007/s42524-019-0028-1

摘要： production is regarded as a new production mode and derived from the production site of Japanese electronics industry. This production mode is proposed to overcome the low flexibility of the assembly line. production has been successfully implemented in Japanese electronics industry, such as Canon and Sony. Benefits from production include rapid response, good flexibility, and high productivity. production has received extensive attention in academic research and production practice. This study reviews the background, characteristics, types, and operation of production. The advantages and applicable scenes of production are summarized from the perspective of business practice. We compare production and famous production modes, i.e., assembly line, cellular manufacturing, and Toyota Production System. The literature on production is surveyed and classified. Furthermore, future research directions are provided.

关键词： seru production production mode flexibility literature review

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Design of a novel side-mounted leg mechanism with high flexibility for a multi-mission quadruped earth

《机械工程前沿（英文）》 2023年第18卷第2期 doi: 10.1007/s11465-022-0740-0

摘要： Earth rover is a class of emerging wheeled-leg robots for nature exploration. At present, few methods for these robots’ leg design utilize a side-mounted spatial parallel mechanism. Thus, this paper presents a complete design process of a novel 5-degree-of-freedom (5-DOF) hybrid leg mechanism for our quadruped earth rover BJTUBOT. First, a general approach is proposed for constructing the novel leg mechanism. Subsequently, by evaluating the basic locomotion task (LT) of the rover based on screw theory, we determine the desired motion characteristic of the side-mounted leg and carry out its two feasible configurations. With regard to the synthesis method of the parallel mechanism, a family of concise hybrid leg mechanisms using the 6-DOF limbs and an L_1F1C limb (which can provide a constraint force and a couple) is designed. In verifying the motion characteristics of this kind of leg, we select a typical (3-UPRU&RRRR)&R mechanism and then analyze its kinematic model, singularities, velocity mapping, workspace, dexterity, statics, and kinetostatic performance. Furthermore, the virtual quadruped rover equipped with this innovative leg mechanism is built. Various basic and specific LTs of the rover are demonstrated by simulation, which indicates that the flexibility of the legs can help the rover achieve multitasking.

关键词： design synthesis parallel mechanism hybrid leg mechanism screw theory quadruped robot

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Special issue on “Molecular Sensors and Molecular Logic Gates”

Luling Wu , Tony D. James

《化学科学与工程前沿（英文）》 2022年第16卷第1期页码 1-3 doi: 10.1007/s11705-021-2134-y

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Design of bio-oil additives via molecular signature descriptors using a multi-stage computer-aided molecular

《化学科学与工程前沿（英文）》 2022年第16卷第2期页码 168-182 doi: 10.1007/s11705-021-2056-8

摘要： Direct application of bio-oil from fast pyrolysis as a fuel has remained a challenge due to its undesirable attributes such as low heating value, high viscosity, high corrosiveness and storage instability. Solvent addition is a simple method for circumventing these disadvantages to allow further processing and storage. In this work, computer-aided molecular design tools were developed to design optimal solvents to upgrade bio-oil whilst having low environmental impact. Firstly, target solvent requirements were translated into measurable physical properties. As different property prediction models consist different levels of structural information, molecular signature descriptor was used as a common platform to formulate the design problem. Because of the differences in the required structural information of different property prediction models, signatures of different heights were needed in formulating the design problem. Due to the combinatorial nature of higher-order signatures, the complexity of a computer-aided molecular design problem increases with the height of signatures. Thus, a multi-stage framework was developed by developing consistency rules that restrict the number of higher-order signatures. Finally, phase stability analysis was conducted to evaluate the stability of the solvent-oil blend. As a result, optimal solvents that improve the solvent-oil blend properties while displaying low environmental impact were identified.

关键词： computer-aided molecular design bio-oil additives molecular signature descriptor

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Progress on molecular biomarkers and classification of malignant gliomas

null

《医学前沿（英文）》 2013年第7卷第2期页码 150-156 doi: 10.1007/s11684-013-0267-1

摘要：

Gliomas are the most common primary intracranial tumors in adults. Anaplastic gliomas (WHO grade III) and glioblastomas (WHO grade IV) represent the major groups of malignant gliomas in the brain. Several diagnostic, predictive, and prognostic biomarkers for malignant gliomas have been reported over the last few decades, and these markers have made great contributions to the accuracy of diagnosis, therapeutic decision making, and prognosis of patients. However, heterogeneity in patient outcomes may still be observed, which highlights the insufficiency of a classification system based purely on histopathology. Great efforts have been made to incorporate new information about the molecular landscape of gliomas into novel classifications that may potentially guide treatment. In this review, we summarize three distinctive biomarkers, three most commonly altered pathways, and three classifications based on microarray data in malignant gliomas.

关键词： malignant glioma molecular biomarker IDH1 MGMT molecular classification

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Molecular classification and molecular targeted therapy of cancer

null

《医学前沿（英文）》 2013年第7卷第2期页码 147-149 doi: 10.1007/s11684-013-0274-2

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住宅建筑需求侧柔性——定义、柔性负荷及量化方法 Review

罗正意, 彭晋卿, 曹静宇, 殷荣欣, 邹斌, 谭羽桐, 严晋跃

《工程（英文）》 2022年第16卷第9期页码 123-140 doi: 10.1016/j.eng.2022.01.010

摘要：

本文综述了近年来关于住宅建筑需求侧柔性的定义、柔性负荷及柔性量化方法方面的研究。首先，针对建筑需求侧柔性、运行柔性和能源柔性等不同的术语，进行了系统的比较和区分；其次，对住宅建筑主要柔性负荷的运行特性和柔性能力进行了总结和比较；再次，对柔性负荷的建模方法和柔性量化指标也进行了详细的综述和总结。最后，提出了当前建筑需求侧柔性领域存在的一些亟待解决的问题。研究结果表明当前针对住宅建筑需求侧柔性的研究主要以中央空调、储水式电热水器、湿电器、冰箱和照明为主，分别占现有研究的36.7%、25.7%、14.7%、9.2%和8.3%。这些柔性负荷在运行特性、使用频率和柔性能力
方面存在较大的差异，而对于它们实际的响应特性有待进一步研究。此外，本文给出了用于柔性负荷建模的白箱、灰箱和黑箱模型在不同应用场合下适用性的建议；对于柔性量化指标，现有研究主要从功率、时间、能量、效率、经济性和环保性等维度提出了大量的指标，但是缺少统一的柔性量化体系。本文能够帮助读者更好地理解建筑需求侧柔性、区分与柔性相关的不同的术语、了解住宅建筑不同柔性负荷的运行特性和柔性能力，同时也能为柔性负荷的建模和柔性量化的相关研究提供指导。

关键词：住宅建筑需求侧柔性柔性负荷建模方法量化指标

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Meshing stiffness property and meshing status simulation of harmonic drive under transmission loading

《机械工程前沿（英文）》 2022年第17卷第2期 doi: 10.1007/s11465-022-0674-6

摘要： The multitooth meshing state of harmonic drive (HD) is an important basic characteristic of its high transformation precision and high bearing capacity. Meshing force distribution affects the load sharing of the tooth during meshing, and theoretical research remains insufficient at present. To calculate the spatial distributed meshing forces and loading backlashes along the axial direction, an iterative algorithm and finite element model (FEM) is proposed to investigate the meshing state under varied transmission loading. The displacement formulae of meshing point under tangential force are derived according to the torsion of the flexspline cylinder and the bending of the tooth. Based on the relationship of meshing forces and circumferential displacements, meshing forces and loading backlashes in three cross-sections are calculated with the algorithm under gradually increased rotation angles of circular spline, and the results are compared with FEM. Owing to the taper deformation of the cup-shaped flexspline, the smallest initial backlash and the earliest meshing point appear in the front cross-section far from the cup bottom, and then the teeth in the middle cross-section of the tooth rim enter the meshing and carry most of the loading. Theoretical and numerical research show that the flexibility is quite different for varied meshing points and tangential force amplitude because of the change of contact status between the flexspline and the wave generator. The meshing forces and torsional stiffness of the HD are nonlinear with the torsional angle.

关键词： harmonic drive meshing flexibility matrix meshing force loading backlash flexspline contact analysis

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分子电子学的发展 Review

Paven Thomas Mathew, 房丰洲

《工程（英文）》 2018年第4卷第6期页码 760-771 doi: 10.1016/j.eng.2018.11.001

摘要：

分子电子学（moletronics）是用分子作为单元对分子电子学器件进行装配。这是一个包含物理、化学、材料科学及工程等学科的多学科交叉领域。分子电子学致力于使硅元件尺寸进一步减小。科学家已经在等效分子器件方面进行了诸多探索性研究。分子电子学在电子以及光子应用中逐渐产生影响，如导电聚合物、光色材料、有机超导体、电致变色材料等。为了满足减小硅片尺寸的需求，研究人员有必要将这种新型技术引入到分子层面。虽然分子层面仪器的实验验证和建模分析是一项艰巨的任务，但分子电子学领域依然出现了突破性进展。本文将对不同分子器件和潜在的适用于不同器件的分子应用结合起来进行讨论，如分子晶体管、分子二极管、分子电容、分子导线和分子绝缘体等。本文简要讨论未来的发展趋势以及介绍各种基于石墨烯已取得一定研究成果的分子仪器。

关键词：分子电子学分子晶体管分子二极管分子电容器分子导线石墨烯

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Molecular size characterization of heavy oil fractions in vacuum and solution by molecular dynamic simulation

Wenpo REN, Honggang CHEN, Chaohe YANG, Honghong SHAN,

《化学科学与工程前沿（英文）》 2010年第4卷第3期页码 250-256 doi: 10.1007/s11705-009-0281-7

摘要： Two kinds of heavy oils were fractionated into eight fractions by Liquid-Solid Adsorption Chromatography, respectively, and samples were collected to measure properties. According to the elemental analysis, molecular weight and H-NMR data, average molecular structures of polycyclic aromatic and heavy resin were constructed with improved Brown-Ladner (B-L) method and several corrections. And then, the most stable conformations of polycyclic aromatic and heavy resin in vacuum and toluene solution were obtained by molecular dynamic simulation, and the molecular size was gotten via the radius of gyration analysis. The results showed that the radius of gyration of polycyclic aromatic and heavy resin was 0.55–0.70 nm in vacuum and 0.60–0.90 nm in toluene solution. With molecular weight increasing, the molecular size in vacuum and toluene solution also increased. Due to the swelling behavior of solvent, the alkyl side chains of heavy oil molecule in solution were more stretched. Thus, the molecular size in toluene solution was larger than that in vacuum.

关键词： dynamic simulation molecular dynamic behavior molecule Adsorption Chromatography

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Effect of / molecular structures on pyrolysis performance and heat sink of decalin isomers

《化学科学与工程前沿（英文）》 2023年第18卷第1期 doi: 10.1007/s11705-023-2375-z

摘要： Decalin is considered as an important compound of high-energy-density endothermic fuel, which is an ideal on-board coolant for thermal management of advanced aircraft. However, decalin contains two isomers with a tunable composition, and their effects on the pyrolysis performance, such as the heat sink and coking tendency have not been demonstrated. Herein, we investigated the pyrolysis of decalin isomers, i.e., cis-decalin, trans-decalin and their mixtures (denoted as mix-decalin), in order to clarify the effects of the cis-/trans-structures on the pyrolysis performance of decalin fuels. The pyrolysis results confirmed that conversion of the tested fuels (600–725 °C, 4 MPa) decreased in the order cis-decalin > mix-decalin > trans-decalin. Detailed analyses of the pyrolysis products were used to compare the product distributions from cis-decalin, mix-decalin and trans-decalin, and the yields of some typical components (such as cyclohexene, 1-methylcyclohexene, benzene and toluene) showed significant differences, which could be ascribed to deeper cracking of cis-decalin. Additionally, the heat sinks and coking tendencies of the decalins decreased in the order cis-decalin > mix-decalin > trans-decalin. This work demonstrates the relationship between the cis/trans structures and the pyrolysis performance of decalin, which provides a better understanding of the structure-activity relationships of endothermic hydrocarbon fuels.

关键词： endothermic fuel decalin pyrolysis heat sink molecular structure

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Analysis of the dynamic stress of planar flexible-links parallel robots

DU Zhaocai, YU Yueqing, YANG Jianxin

《机械工程前沿（英文）》 2007年第2卷第2期页码 152-158 doi: 10.1007/s11465-007-0025-7

摘要： This paper presents a method for the dynamic stress analysis of planar parallel robots with flexible links and a rigid moving platform. The finite element-based dynamic model of flexible parallel robots is proposed. The relation between elastic deformations and elastic displacements of the flexible links is investigated, considering the coupling effects of elastic motion and rigid motion. The elastic deformations of links are calculated. Considering the effects of bending-shearing strain and tensile-compression strain, the dynamic stress of the links and its position are derived by using the Kineto-Elastodynamics theory and the Timoshenko beam theory. Due to the flexibility of the links, the dynamic stresses are well illustrated through numerical simulation. Compared with the results of the finite element software SAMCEF, the numerical simulation results show the good coherence and advantages of the analysis method. The dynamic stress analysis is demonstrated to have a significant impact on the analysis, design and control of flexible parallel robots.

关键词： numerical simulation Due coupling software SAMCEF flexibility