位置：成果数据库 > 期刊 > 期刊详情页
Optimization of CHARMM force field parameters for the chalcone fragment
  • ISSN号：1674-7291
  • 期刊名称：Science China Chemistry
  • 时间：0
  • 页码：2580-2586
  • 相关项目：查耳酮合成酶和白藜芦醇合成酶催化反应机理的理论研究
作者： Harbin University of Science and Technology|Harbin 150080|China 2 Academy of Fundamental and Interdisciplina|Department of Chemistry|Harbin Institute of Technology||......
同期刊论文项目
查耳酮合成酶和白藜芦醇合成酶催化反应机理的理论研究
期刊论文 22
同项目期刊论文
Influence of lattice dynamics on charge transport in the dianthra[2,3-b:2 ';,3 ';-f]-thieno[3,2-b]th
Theoretical study of the reaction mechanism of Mycobacterium tuberculosis type II dehydroquinate deh
Toward a full structural characterization of G-quadruplex DNA in aqueous solution: Molecular dynamic
Theoretical studies of the reactions of Cl atoms with CF3CH2OCHnF(3-n) (n=1, 2, 3)
The reaction mechanism for dehydration process catalyzed by type I dehydroquinate dehydratase from G
Theoretical study on the reactions of trimethylsilane with chlorine and bromine atoms
Molecular dynamics studies of the 3D structure and planar ligand binding of a quadruplex dimer
Molecular Dynamics Study on the Interactions of Porphyrin with Two Antiparallel Human Telomeric Quad
Dual-level direct dynamics studies on the reactions of tetramethylsilane with chlorine and bromine a
Theoretical studies and rate constants calculation for the reactions of acetone with fluorine and br
Theoretical Studies on the Reactions CH3SCH3 with OH, CF3, and CH3 Radicals
Theoretical study and rate constants calculation for the reactions X+CF3CH2OCF3 (X = F, Cl, Br)
New insights into the mechanism of the Schiff base formation catalyzed by type I dehydroquinate dehy
Theoretical Study on the Reaction CX3 + SiH(CH3)(3) (X = H, F)
New insights into the mechanism of the Schiff base hydrolysis catalyzed by type I dehydroquinate deh
Phase dependence of hole mobilities in dibenzo-tetrathiafulvalene crystal: A first-principles study
苯乙酮烯醇式互换异构对聚乙烯电树枝老化性能影响的理论研究
OXO（X=Cl,Br）自由基与CO和NO自由基反应机理的理论研究