目的基于网络药理学方法及分子对接技术探讨益气解毒通络方(YQJDTLF)治疗肝硬化的作用靶点及信号通路,预测其潜在作用机制。方法基于TCMSP数据库提取YQJDTLF的有效活性成分及作用靶点,通过Drugbank、OMIM、TTD、DisGeNET获取肝硬化治疗...目的基于网络药理学方法及分子对接技术探讨益气解毒通络方(YQJDTLF)治疗肝硬化的作用靶点及信号通路,预测其潜在作用机制。方法基于TCMSP数据库提取YQJDTLF的有效活性成分及作用靶点,通过Drugbank、OMIM、TTD、DisGeNET获取肝硬化治疗靶点,筛选共同靶点;使用Cytoscape软件构建“药物有效活性成分-疾病靶点”可视化调控网络图,利用STRING数据库构建蛋白互作网络图(PPI),然后运用Cytoscape对PPI进行核心蛋白的筛选;最后,通过Metascape对核心靶点进行基因本体(GO)功能富集分析和KEGG通路富集分析,最后完成分子对接。结果共获得93个有效活性成分,135个共同靶点;主要活性化合物包括槲皮素、黄芩素、豆甾醇等;KEGG通路富集分析得出135条通路,涉及癌症信号通路(pathways in cancer)等通路;通过分子对接发现关键中药成分与关键靶点之间的结合活性良好。结论YQJDTLF具有多成分、多靶点、多通路的作用特点,可通过调节相关通路与靶点起到治疗肝硬化的作用。展开更多
Delta carbonate (Delta C, AC) method is a commonly- used surface geochemical exploration method for petroleum surveys. Delta C holds that light hydrocarbon gases leak into near-surface soils or sediments from underl...Delta carbonate (Delta C, AC) method is a commonly- used surface geochemical exploration method for petroleum surveys. Delta C holds that light hydrocarbon gases leak into near-surface soils or sediments from underlying petroleum accumulations, then partly oxidized to CO2, resulting in a special carbonate precipitation, which is termed as Delta carbonate (△C).展开更多
Oil cracking gas plays an important role in the resources of natural gas in the basins with high and over mature marine source rocks in China. The prediction of the oil cracking gas resources becomes nec-essary and ur...Oil cracking gas plays an important role in the resources of natural gas in the basins with high and over mature marine source rocks in China. The prediction of the oil cracking gas resources becomes nec-essary and urgent in the gas exploration in these basins. A marine crude oil sample was pyrolyzed using sealed gold tubes system. The pyrolysates including gas,liquid and solid were quantitatively analyzed. Based on the pyrolysis data and kinetic calculation,the yield correlativity among gas,liquid and solid products was regressed with high correlative coefficients to establish a prediction model suitable for the resource estimation of oil cracking gas. The verification formula for this model was also established on the principle of mass conservation. The affecting factors and the application precondi-tions of this prediction model were discussed. This model would enlighten and provide some new ideas for the resource assessment of natural gas in the high and over mature marine carbonate source rock areas in China. It is expected to be valuable in gas exploration.展开更多
On the basis of the results of simulation experiments, now we better understand the contribution of high carbon number hydrocarbons to diamondoid generation during thermal pyrolysis of crude oil and its sub-fractions(...On the basis of the results of simulation experiments, now we better understand the contribution of high carbon number hydrocarbons to diamondoid generation during thermal pyrolysis of crude oil and its sub-fractions(saturated, aromatic, resin, and asphalene fractions). However, little is known about the effect of volatile components in oil on diamondoid generation and diamondoid indices due to the lack of attention to these components in experiments. In this study, the effect of volatile components in oil on diamondoid generation and maturity indices was investigated by the pyrolysis simulation experiments on a normal crude oil from the HD23 well of the Tarim Basin and its residual oil after artificial volatilization, combined with quantitative analysis of diamondoids. The results indicate that the volatile components(≤n C12) in oil have an obvious contribution to the generation of adamantanes, which occurs mainly in the early stage of oil cracking(Easy Ro<1.0%), and influences the variations in maturity indices of adamantanes; but they have no obvious effect on the generation and maturity indices of diamantanes. Therefore, some secondary alterations e.g., migration, gas washing, and biodegradation, which may result in the loss of light hydrocarbons in oil under actual geological conditions, could affect the identification of adamantanes generated during the late-stage cracking of crude oil, and further influence the practical application of adamantane indices.展开更多
Branched glycerol dialkyl glycerol tetraethers(brGDGTs),likely produced by bacteria in soil and peat,are widely distributed,easily detected,newly adopted biomarker compounds.In this study,brGDGTs were used to explore ...Branched glycerol dialkyl glycerol tetraethers(brGDGTs),likely produced by bacteria in soil and peat,are widely distributed,easily detected,newly adopted biomarker compounds.In this study,brGDGTs were used to explore the relationship between the absolute abundance of brGDGTs and the distribution of oil and gas fields in the Duoshiqiao area of the Jiyang depression.The results showed that the concentrations at the Xiakou fault and in the oil and gas fields were obviously higher than those in the contrast areas.The clear relationship among the concentration of brGDGTs,the distribution of oil and gas fields,and the acidolysis hydrocarbon(ethane)indicates that the concentration effectively responds to hydrocarbon seeps from the oil and gas field below.brGDGTs may become some of the most important indicators in surface geochemical prospecting for oil and gas.展开更多
The carbon isotopic composition of individual light hydrocarbons generated from source rocks that had been pyrolysed in vacuum glass tube were determined by using the GC-IRMS techniques. The results indicate that abun...The carbon isotopic composition of individual light hydrocarbons generated from source rocks that had been pyrolysed in vacuum glass tube were determined by using the GC-IRMS techniques. The results indicate that abundant CO2 in the pyrolysates has a remarkable effect on the determination of CH4δ13C. Running cryogenically with an initial temperature of -40℃ can effectively eliminate the effect. In addition, it conduces to measuring the δ13C of C2+ hydrocarbons by increasing the injection volume and/or absorbing CO2 with the solution of sodium hydroxide. The above measures will help to get the carbon isotopic composition of C1-C7 components, which is of great significance for gas/source rock correlation and for study on the genesis of natural gas.展开更多
Oxy-fuel combustion power systems can utilize the cold energy released during the liquefied natural gas(LNG)regasification to reduce the power consumption of CO_(2) capture,but the specific LNG cold energy consumption...Oxy-fuel combustion power systems can utilize the cold energy released during the liquefied natural gas(LNG)regasification to reduce the power consumption of CO_(2) capture,but the specific LNG cold energy consumption of CO_(2) capture is still too large.To recover more CO_(2) with the limited LNG cold energy at a low energy cost,a novel natural gas-fired oxy-fuel power system with the cascade utilization of LNG cold energy is proposed in this work,where the LNG cold energy could be sequentially utilized in the air separation unit and the CO_(2) recovery process.The new system is evaluated with the Aspen Plus software.The results show that the net electrical efficiency and the specific primary energy consumption for CO_(2) avoided(SPECCA)of the new system are comparable to those of the chemical looping combustion cycle,and superior to those of the conventional O_(2)/CO_(2) cycles.Moreover,the specific LNG needed for CO_(2) avoided(SLNCC)of the new system is more than 67.2%lower than the existing oxy-fuel power systems utilizing the LNG cold energy.Furthermore,it is found that the O_(2) purity of 97.0 mol.%and the CO_(2) capture ratio of 97.0%are optimal conditions,because the SPECCA,the specific exergy consumption for CO_(2) avoided(SECCA)and the SLNCC are at the minimum of 1.87 GJLHV⋅t_(CO_(2))^(−1),2.60GJ⋅t_(CO_(2))^(−1) and 1.88tLNG⋅t_(CO_(2))^(−1),respectively.Meanwhile,the net electrical efficiency and the exergy efficiency of the new system reach 51.51%and 49.23%,respectively.展开更多
Ultra wideband (UWB) network brings both chance and challenge to personal area wireless communications. Compared with other IEEE 802 small range wireless protocols (such as WLAN and Bluetooth), UWB has both extrem...Ultra wideband (UWB) network brings both chance and challenge to personal area wireless communications. Compared with other IEEE 802 small range wireless protocols (such as WLAN and Bluetooth), UWB has both extremely high bandwidth (up to 480 Mbpa) and low radiation. Moreover, the structured MAC layer of UWB is the fundamental difference to WLAN. The top one is that only when two UWB devices belong to the same piconet can they communicate with each other directly, which means that we must jointly consider topology formation and routing when deploying UWB networks because the interaction between routing and topology formation makes separate optimization ineffective. This paper tries to optimize UWB network from a cross-layer point of view. Specifically, given device spatial distribution and traffic requirement, we want to form piconets and determine routing jointly, to maximize the overall throughput. We formulate the problem of joint optimization to mixed-integer programming and give a practical lower bound that is very close to the theoretical upper bound in our simulation. Furthermore, our lower bound is much better than an algorithm that only considers topology formation in UWB networks.展开更多
文摘目的基于网络药理学方法及分子对接技术探讨益气解毒通络方(YQJDTLF)治疗肝硬化的作用靶点及信号通路,预测其潜在作用机制。方法基于TCMSP数据库提取YQJDTLF的有效活性成分及作用靶点,通过Drugbank、OMIM、TTD、DisGeNET获取肝硬化治疗靶点,筛选共同靶点;使用Cytoscape软件构建“药物有效活性成分-疾病靶点”可视化调控网络图,利用STRING数据库构建蛋白互作网络图(PPI),然后运用Cytoscape对PPI进行核心蛋白的筛选;最后,通过Metascape对核心靶点进行基因本体(GO)功能富集分析和KEGG通路富集分析,最后完成分子对接。结果共获得93个有效活性成分,135个共同靶点;主要活性化合物包括槲皮素、黄芩素、豆甾醇等;KEGG通路富集分析得出135条通路,涉及癌症信号通路(pathways in cancer)等通路;通过分子对接发现关键中药成分与关键靶点之间的结合活性良好。结论YQJDTLF具有多成分、多靶点、多通路的作用特点,可通过调节相关通路与靶点起到治疗肝硬化的作用。
基金supported by National Natural Science Foundation of China(grant No.41302099)Open Foundation of State Key Laboratory of Organic Geochemistry(grant No.OG2015-03)Open Foundation of Key Laboratory of Marine Mineral Resources,Ministry of Land and Resources(grant No.KLMMR-2013-A-25)
文摘Delta carbonate (Delta C, AC) method is a commonly- used surface geochemical exploration method for petroleum surveys. Delta C holds that light hydrocarbon gases leak into near-surface soils or sediments from underlying petroleum accumulations, then partly oxidized to CO2, resulting in a special carbonate precipitation, which is termed as Delta carbonate (△C).
基金Supported by the National Natural Science Foundation of China (Grant No. 40372070)
文摘Oil cracking gas plays an important role in the resources of natural gas in the basins with high and over mature marine source rocks in China. The prediction of the oil cracking gas resources becomes nec-essary and urgent in the gas exploration in these basins. A marine crude oil sample was pyrolyzed using sealed gold tubes system. The pyrolysates including gas,liquid and solid were quantitatively analyzed. Based on the pyrolysis data and kinetic calculation,the yield correlativity among gas,liquid and solid products was regressed with high correlative coefficients to establish a prediction model suitable for the resource estimation of oil cracking gas. The verification formula for this model was also established on the principle of mass conservation. The affecting factors and the application precondi-tions of this prediction model were discussed. This model would enlighten and provide some new ideas for the resource assessment of natural gas in the high and over mature marine carbonate source rock areas in China. It is expected to be valuable in gas exploration.
基金financially supported by the National Natural Science Foundation of China(Grant Nos.41172115&41372138)the National Science&Technology Major Project of the Ministry of Science and Technology of China(Grant No.2011ZX05008-002-32)China Postdoctoral Science Foundation(Grant No.2014M561002)
文摘On the basis of the results of simulation experiments, now we better understand the contribution of high carbon number hydrocarbons to diamondoid generation during thermal pyrolysis of crude oil and its sub-fractions(saturated, aromatic, resin, and asphalene fractions). However, little is known about the effect of volatile components in oil on diamondoid generation and diamondoid indices due to the lack of attention to these components in experiments. In this study, the effect of volatile components in oil on diamondoid generation and maturity indices was investigated by the pyrolysis simulation experiments on a normal crude oil from the HD23 well of the Tarim Basin and its residual oil after artificial volatilization, combined with quantitative analysis of diamondoids. The results indicate that the volatile components(≤n C12) in oil have an obvious contribution to the generation of adamantanes, which occurs mainly in the early stage of oil cracking(Easy Ro<1.0%), and influences the variations in maturity indices of adamantanes; but they have no obvious effect on the generation and maturity indices of diamantanes. Therefore, some secondary alterations e.g., migration, gas washing, and biodegradation, which may result in the loss of light hydrocarbons in oil under actual geological conditions, could affect the identification of adamantanes generated during the late-stage cracking of crude oil, and further influence the practical application of adamantane indices.
基金supported by the Knowledge Innovation Program of the Chinese Academy of Sciences (Grant No. KZCXZ-YW-JC103)contribution no.1866 from Guangzhou Institute of Geochemistry, Chinese Academy of Sciences
文摘Branched glycerol dialkyl glycerol tetraethers(brGDGTs),likely produced by bacteria in soil and peat,are widely distributed,easily detected,newly adopted biomarker compounds.In this study,brGDGTs were used to explore the relationship between the absolute abundance of brGDGTs and the distribution of oil and gas fields in the Duoshiqiao area of the Jiyang depression.The results showed that the concentrations at the Xiakou fault and in the oil and gas fields were obviously higher than those in the contrast areas.The clear relationship among the concentration of brGDGTs,the distribution of oil and gas fields,and the acidolysis hydrocarbon(ethane)indicates that the concentration effectively responds to hydrocarbon seeps from the oil and gas field below.brGDGTs may become some of the most important indicators in surface geochemical prospecting for oil and gas.
文摘The carbon isotopic composition of individual light hydrocarbons generated from source rocks that had been pyrolysed in vacuum glass tube were determined by using the GC-IRMS techniques. The results indicate that abundant CO2 in the pyrolysates has a remarkable effect on the determination of CH4δ13C. Running cryogenically with an initial temperature of -40℃ can effectively eliminate the effect. In addition, it conduces to measuring the δ13C of C2+ hydrocarbons by increasing the injection volume and/or absorbing CO2 with the solution of sodium hydroxide. The above measures will help to get the carbon isotopic composition of C1-C7 components, which is of great significance for gas/source rock correlation and for study on the genesis of natural gas.
基金the financial support from the National Natural Science Foundation of China(No.51106063)the Dean Project of Guangxi Key Laboratory of Petrochemical Resource Processing and Process Intensification Technology(No.2013K004)。
文摘Oxy-fuel combustion power systems can utilize the cold energy released during the liquefied natural gas(LNG)regasification to reduce the power consumption of CO_(2) capture,but the specific LNG cold energy consumption of CO_(2) capture is still too large.To recover more CO_(2) with the limited LNG cold energy at a low energy cost,a novel natural gas-fired oxy-fuel power system with the cascade utilization of LNG cold energy is proposed in this work,where the LNG cold energy could be sequentially utilized in the air separation unit and the CO_(2) recovery process.The new system is evaluated with the Aspen Plus software.The results show that the net electrical efficiency and the specific primary energy consumption for CO_(2) avoided(SPECCA)of the new system are comparable to those of the chemical looping combustion cycle,and superior to those of the conventional O_(2)/CO_(2) cycles.Moreover,the specific LNG needed for CO_(2) avoided(SLNCC)of the new system is more than 67.2%lower than the existing oxy-fuel power systems utilizing the LNG cold energy.Furthermore,it is found that the O_(2) purity of 97.0 mol.%and the CO_(2) capture ratio of 97.0%are optimal conditions,because the SPECCA,the specific exergy consumption for CO_(2) avoided(SECCA)and the SLNCC are at the minimum of 1.87 GJLHV⋅t_(CO_(2))^(−1),2.60GJ⋅t_(CO_(2))^(−1) and 1.88tLNG⋅t_(CO_(2))^(−1),respectively.Meanwhile,the net electrical efficiency and the exergy efficiency of the new system reach 51.51%and 49.23%,respectively.
文摘Ultra wideband (UWB) network brings both chance and challenge to personal area wireless communications. Compared with other IEEE 802 small range wireless protocols (such as WLAN and Bluetooth), UWB has both extremely high bandwidth (up to 480 Mbpa) and low radiation. Moreover, the structured MAC layer of UWB is the fundamental difference to WLAN. The top one is that only when two UWB devices belong to the same piconet can they communicate with each other directly, which means that we must jointly consider topology formation and routing when deploying UWB networks because the interaction between routing and topology formation makes separate optimization ineffective. This paper tries to optimize UWB network from a cross-layer point of view. Specifically, given device spatial distribution and traffic requirement, we want to form piconets and determine routing jointly, to maximize the overall throughput. We formulate the problem of joint optimization to mixed-integer programming and give a practical lower bound that is very close to the theoretical upper bound in our simulation. Furthermore, our lower bound is much better than an algorithm that only considers topology formation in UWB networks.