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1.
Solvent Influence on Cellulose 1,4‐β‐Glycosidic Bond Cleavage: A Molecular Dynamics and Metadynamics Study 下载免费PDF全文
Claudia Loerbroks Eliot Boulanger Prof. Dr. Walter Thiel 《Chemistry (Weinheim an der Bergstrasse, Germany)》2015,21(14):5477-5487
We explore the influence of two solvents, namely water and the ionic liquid 1‐ethyl‐3‐methylimidazolium acetate (EmimAc), on the conformations of two cellulose models (cellobiose and a chain of 40 glucose units) and the solvent impact on glycosidic bond cleavage by acid hydrolysis by using molecular dynamics and metadynamics simulations. We investigate the rotation around the glycosidic bond and ring puckering, as well as the anomeric effect and hydrogen bonds, in order to gauge the effect on the hydrolysis mechanism. We find that EmimAc eases hydrolysis through stronger solvent–cellulose interactions, which break structural and electronic barriers to hydrolysis. Our results indicate that hydrolysis in cellulose chains should start from the ends and not in the centre of the chain, which is less accessible to solvent. 相似文献
2.
The rational and sustainable exploitation of nature resources is one of the priority objectives of our society. In this article a method is proposed to evaluate and exploit the energetic resources contained in different forest formations. This method is based on the use of a combustion bomb calorimeter to determine the calorific values of the different samples studied. These results were complemented with chemical analysis of the samples and with environmental and geomorphological studies of the zones were samples were taken. The results obtained during the last 3 years for the residual biomass originated from the forest formations existing in Galicia ensure the reliability and usefulness of the method that can be extended to any forest formation all over the world. 相似文献
3.
ABSTRACT. Predator‐prey relationships account for an important part of all interactions betweenspecies. In this paper we provide a microfoundation for such predator‐prey relations in afood chain. Basic entities of our analysis are representative organisms of species modeled similar to economic households. With prices as indicators of scarcity, organisms are assumed to behave as if they maximize their net biomass subject to constraints which express the organisms' risk of being preyed upon during predation. Like consumers, organisms face a ‘budget constraint’ requiring their expenditure on prey biomass not to exceed their revenue from supplying own biomass. Short‐run ecosystem equilibria are defined and derived. The net biomass acquired by the representative organism in the short term determines the positive or negative population growth. Moving short‐run equilibria constitute the dynamics of the predator‐prey relations that are characterized in numerical analysis. The population dynamics derived here turn out to differ significantly from those assumed in the standard Lotka‐Volterra model. 相似文献
4.
It is shown that the presence of mixed-culture growth in batch fermentation processes can be very accurately inferred from total biomass data by means of the wavelet analysis for singularity detection. This is accomplished by considering simple phenomenological models for the mixed growth and the more complicated case of mixed growth on a mixture of substrates. The main quantity provided by the wavelet analysis is the Hölder exponent of the singularity that we determine for our illustrative examples. The numerical results point to the possibility that Hölder exponents can be used to characterize the nature of the mixed-culture growth in batch fermentation processes with potential industrial applications. Moreover, the analysis of the same data affected by the common additive Gaussian noise still lead to the wavelet detection of the singularities although the Hölder exponent is no longer a useful parameter. 相似文献
5.
丹麦生物质发电的现状和研究发展趋势 总被引:9,自引:7,他引:9
丹麦是世界上利用秸秆生物质燃烧发电技术开发、运行最好的国家,其经验值得中国借鉴。根据作者在丹麦对生物质燃烧发电的研究经历,系统地介绍了丹麦在秸秆生物质发电的经验、遇到的问题及相应的研究和今后的发展方向。 相似文献
6.
采用改进颗粒床模型的CFD方法模拟了实验室规模冷模装置内鼓泡床的流体流动时空特性。模拟结果表明表观气速是影响气固动态特征和压力波动的主要因素之一:随表观气速的增大,气泡数目增加,气泡体积增大,压力波动增强;气速越高时均压降越大;在内循环鼓泡流化床内固体颗粒呈“单室”流型。上述与实验观察相吻合的模拟结果将有助于放大和设计商业化的内循环流化床生物质气化炉。 相似文献
7.
Photosynthetic suspension cultures of higher plants offer an alternative approach to biomass production, potentially yielding
cellulosic material and protein on a continuous year-round basis. A bench-top hybrid photobioreactor was developed to study
photomixotrophic and photoautotrophic growth of Glycine max as a model system. Maximum biomass doubling times for photomixotrophic
and photoautotrophic growth were 1.87 and 3.92 d, respectively. The presence of exogenous sugars resulted in photomixotrophic
growth, reduced chlorophyll levels, and a reduction in photosynthetically-evolved oxygen. Depletion of carbohydrates from
the medium coincided with the beginning of stationary phase and an increase in oxygen evolution by the cells. A second growth
phase, prolonging cell viability, could be initiated by increasing the carbon dioxide from 2 to 5%, just before the onset
of stationary phase. Biomass from bioreactor cultured cells proved resistant to enzymatic attack without pretreatment. Composition
of the biomass was 7.8% lignin, 20.7% α-cellulose, 23% hemicellulose, 5.5% starch, 14.5% protein and 6.5% nucleic acids. 相似文献
8.
Development of a multicriteria assessment model for ranking biomass feedstock collection and transportation systems 总被引:1,自引:0,他引:1
Amit Kumar Shahab Sokhansanj Peter C. Flynn 《Applied biochemistry and biotechnology》2006,129(1-3):71-87
This study details multicriteria assessment methodology that integrates economic, social, environmental, and technical factors
in order to rank alternatives for biomass collection and transportation systems. Ranking of biomass collection systems is
based on cost of delivered biomass, quality of biomass supplied, emissions during collection, energy input to the chain operations,
and maturity of supply system technologies. The assessment methodology is used to evaluate alternatives for collecting 1.8×106 dry t/yr based on assumptions made on performance of various assemblies of biomass collection systems is based on cost of
delivered biomass, quality of biomass supplied, emissions during collection, energy input to the chain operations, and maturity
of supply system technologies. The assessment methodology is used to evaluate alternatives for collecting 1.8×106 dry t/yr based on assumptions made on performance of various assemblies of biomass collection systems. A proposed collection
option using loafer/stacker was shown to be the best option followed by ensiling and baling. Ranking of biomass transport
systems is based on cost of biomass transport, emissions during transport, traffic congestion, and maturity of different technologies.
At a capacity of 4×106 dry t/yr, rail transport was shown to be the best option, followed by truck transport and pipeline transport, respectively.
These rankings depend highly on assumed maturity of technologies and scale of utilization. These may change if technologies
such as loafing or ensiling (wet storage) methods are proved to be infeasible for large-scale collection systems. 相似文献
9.
生物质热解油气化试验研究 总被引:14,自引:1,他引:14
生物质是一种环境友好可再生资源,可以通过多种途径转化为液体燃料。生物质热解液化即是在缺氧状态下对生物质进行快速加热,然后再对热解产物进行快速冷凝,最后获得一种称为生物油的液体燃料的技术。该技术以及生物油的特点主要有:热解液化温度为500℃,远低于生物质热解气化所 相似文献
10.
The effect of ammonium nitrate concentration in the citric acid biosynthesis by Aspergillus niger NC-12 in single-stage continuous cultures with biomass retention was investigated. Experiments were carried out in a BIOMER
laboratory fermenter with 5 dm3 working volume. At the initial stage of each cultivation, the substrate in the bioreactor contained 1.5 g NH4NO3 dm−3. After 120 h onwards, the bioreactor was fed continuously at a constant dilution rate of 0.009 h−1. NH4NO3 concentration in the feed was varied from one culture to another, ranging between 0.5 g dm−3 and 2.5 g dm−3. Promising results were obtained when NH4NO3 concentration of 1.5 g dm−3 was used. The observed concentration of citric acid (c
P) and yield of citric acid with respect to the introduced sucrose (Y
P/S) were 117.88 g dm−3 and 78.59 %, respectively. The efficiency coefficient of citric acid biosynthesis (K
ef) was very high, amounting to 83.38.
Presented at the 33rd International Conference of the Slovak Society of Chemical Engineering, Tatranské Matliare, 22–26 May
2006. 相似文献