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A Study of thermal decomposition in cellulose by molecular dynamics simulation
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作者 Chao Liu De-Zheng Jiang +1 位作者 Shun-An Wei jin-bao huang 《Natural Science》 2009年第1期41-46,共6页
PM3 method was used in this paper to optimize cellulose molecular structure which is the main component of biomass and a series of struc-tural parameter was attained. The single chain of cellulose (the degree of polym... PM3 method was used in this paper to optimize cellulose molecular structure which is the main component of biomass and a series of struc-tural parameter was attained. The single chain of cellulose (the degree of polymerization is 9) was simulated in different force fields by mo-lecular dynamic method. Energy history, depo-sition temperature and the cracked groups of simulation process in different force fields was gotten, of which Amber force field is quite matched to the experiments data. By simulating the process of cellulose thermal decomposition with MD which is based on Amber force field and quantum mechanics, we get the sequence of bond break of cellulose molecule and the first cracked group. Also, the first production was analyzed. The heating process includes two stages: vibrate at low temperature and break at high temperature (273k-375k) and breaking stage when the temperature of the system ar-rived at 375K. 展开更多
关键词 Molecular Dynamics Simulation CELLULOSE Thermal DECOMPOSITION BOND BREAKS
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Diverse species of Colletotrichum associated with grapevine anthracnose in China 被引量:9
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作者 Ji-Ye Yan M.M.R.S.Jayawardena +10 位作者 Ishani D.Goonasekara Yong Wang Wei Zhang Mei Liu jin-bao huang Zhong-Yue Wang Jing-Jing Shang You-Liang Peng Ali Bahkali Kevin D.Hyde Xing-Hong Li 《Fungal Diversity》 SCIE 2015年第2期233-246,共14页
Grapevine anthracnose is an important disease,responsible for mild to severe yield losses in grape production,and is also an important post harvest disease.The disease was studied in vineyards in six provinces in Chin... Grapevine anthracnose is an important disease,responsible for mild to severe yield losses in grape production,and is also an important post harvest disease.The disease was studied in vineyards in six provinces in China,with 34 isolates obtained from diseased grapes.Multi-gene(ACT,ITS,GAPDH,TUB2 and CHS)analysis coupled with morphology showed that Colletotrichum aenigma,C.hebeiense sp.nov.and C.viniferum were associated with grapevine anthracnose in China.Colletotrichum aenigma is reported for the first time as associated with grapevine anthracnose.Colletotrichum hebeiense is a new species introduced here.Pathogenicity testing showed that all species can infect grapes,causing anthracnose however,virulence of species and isolates showed great variation.Phylogenetic analysis showed that C.viniferum is a cryptic species and its taxonomy needs to be resolved in the future. 展开更多
关键词 Colletotrichum aenigma Disease symptoms VIRULENCE Grape ripe rot Multi-gene
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