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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
关键词: dynamic simulation molecular dynamic behavior molecule Adsorption Chromatography
《机械工程前沿(英文)》 2023年 第18卷 第1期 doi: 10.1007/s11465-022-0733-z
关键词: grinding minimum quantity lubrication carbon group nanofluid tribological mechanism
Bo Chen, Yan Dai, Xuehua Ruan, Yuan Xi, Gaohong He
《化学科学与工程前沿(英文)》 2018年 第12卷 第2期 页码 296-305 doi: 10.1007/s11705-018-1701-3
关键词: membrane vapor separation membrane process modeling process engineering free volume theory volatile organic compound
Boksoon KWON, Noeon PARK, Jaeweon CHO,
《环境科学与工程前沿(英文)》 2010年 第4卷 第2期 页码 172-182 doi: 10.1007/s11783-010-0002-y
关键词: dynamic membrane natural organic matters ultrafiltration membrane performance effective PSD effective molecular weight cutoff
Molecular dynamic simulation on the conformation of mouse muscle type nAChR
Shengai SUN, Rilei YU, Yanhui ZHANG, Yanni LI,
《化学科学与工程前沿(英文)》 2010年 第4卷 第3期 页码 348-352 doi: 10.1007/s11705-009-0284-4
关键词: pentameric hydrophilic Tyr127 cryoelectron microscopic conformation
Molecular diffusion in ternary poly(vinyl alcohol) solutions
《化学科学与工程前沿(英文)》 2022年 第16卷 第6期 页码 1003-1016 doi: 10.1007/s11705-021-2121-3
关键词: fluorescence correlation spectroscopy poly(vinyl alcohol) anomalous diffusion crowding effects dynamic light scattering binding effects rhodamine B
Progress and prospect of hydrate-based desalination technology
Jibao ZHANG, Shujun CHEN, Ning MAO, Tianbiao HE
《能源前沿(英文)》 2022年 第16卷 第3期 页码 445-459 doi: 10.1007/s11708-021-0740-5
关键词: gas hydrates desalination crystal morphology molecular dynamic cold energy
Static and dynamic characteristics of SO
Shi Yin, Yan-Qiu Chen, Yue-Li Li, Wang-Lai Cen, Hua-Qiang Yin
《环境科学与工程前沿(英文)》 2018年 第12卷 第5期 doi: 10.1007/s11783-018-1058-3
To derive liquid fuel from waste engine oil and plastics thorough pyrolysis process. To make equal blend of waste engine oil and plastics with diesel fuel. To find the suitability of fuel from waste in diesel engine through performance, emission and combustion characteristics.
关键词: Molecular dynamics Flue gas desulfurization Graphene Sulfur dioxide Heterogeneous catalysis
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
《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
关键词: computer-aided molecular design bio-oil additives molecular signature descriptor
A review on ductile mode cutting of brittle materials
Elijah Kwabena ANTWI, Kui LIU, Hao WANG
《机械工程前沿(英文)》 2018年 第13卷 第2期 页码 251-263 doi: 10.1007/s11465-018-0504-z
Brittle materials have been widely employed for industrial applications due to their excellent mecha-nical, optical, physical and chemical properties. But obtaining smooth and damage-free surface on brittle materials by traditional machining methods like grinding, lapping and polishing is very costly and extremely time consuming. Ductile mode cutting is a very promising way to achieve high quality and crack-free surfaces of brittle materials. Thus the study of ductile mode cutting of brittle materials has been attracting more and more efforts. This paper provides an overview of ductile mode cutting of brittle materials including ductile nature and plasticity of brittle materials, cutting mechanism, cutting characteristics, molecular dynamic simulation, critical undeformed chip thickness, brittle-ductile transition, subsurface damage, as well as a detailed discussion of ductile mode cutting enhancement. It is believed that ductile mode cutting of brittle materials could be achieved when both crack-free and no subsurface damage are obtained simultaneously.
关键词: ductile mode cutting brittle materials critical undeformed chip thickness brittle-ductile transition subsurface damage molecular dynamic simulation
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
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
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
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
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。
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
关键词: endothermic fuel decalin pyrolysis heat sink molecular structure
标题 作者 时间 类型 操作
Molecular size characterization of heavy oil fractions in vacuum and solution by molecular dynamic simulation
Wenpo REN, Honggang CHEN, Chaohe YANG, Honghong SHAN,
期刊论文
mechanism of carbon group nanofluids on grinding interface under minimum quantity lubrication based on moleculardynamic simulation
期刊论文
Integration of molecular dynamic simulation and free volume theory for modeling membrane VOC/gas separation
Bo Chen, Yan Dai, Xuehua Ruan, Yuan Xi, Gaohong He
期刊论文
Effects of a dynamic membrane formed with polyethylene glycol on the ultrafiltration of natural organic
Boksoon KWON, Noeon PARK, Jaeweon CHO,
期刊论文
Molecular dynamic simulation on the conformation of mouse muscle type nAChR
Shengai SUN, Rilei YU, Yanhui ZHANG, Yanni LI,
期刊论文
Progress and prospect of hydrate-based desalination technology
Jibao ZHANG, Shujun CHEN, Ning MAO, Tianbiao HE
期刊论文
Static and dynamic characteristics of SO
Shi Yin, Yan-Qiu Chen, Yue-Li Li, Wang-Lai Cen, Hua-Qiang Yin
期刊论文
Design of bio-oil additives via molecular signature descriptors using a multi-stage computer-aided molecular
期刊论文