设为首页
收藏本站
网站地图
|
English
|
公务邮箱
About the library
Background
History
Leadership
Organization
Readers' Guide
Opening Hours
Collections
Help Via Email
Publications
Electronic Information Resources
常用资源
电子图书
期刊论文
学位会议
外文资源
特色专题
内部出版物
知网期刊论文(1)
在“
Elsevier电子期刊
”中,
命中:
6
条,耗时:小于0.01 秒
在所有数据库中总计命中:
1
条
1.
MDMC
2
: A molecular dynamics code for investigating the fragmentation dynamics of multiply charged clusters
作者:
David A. Bonhommeau
;
Marie
-
Pierre
Gaigeot
关键词:
Molecular dynamics simulations
;
Mesoscopic coarse-grained models
;
Charged clusters and droplets
;
Electrospray ionisation
;
Evaporation
;
Fission
刊名:Computer Physics Communications
出版年:February, 2014
2.
O-H anharmonic vibrational motions in Cl
鈭?/sup>鈰?CH
3
OH)
1鈭?
ionic clusters. Combined IRPD experiments and AIMD simulations
作者:
Jordan P. Beck
;
Alvaro Cimas
;
James M. Lisy
;
Marie
-
Pierre
Gaigeot
关键词:
Vibrational spectroscopy
;
IR-PD
;
DFT-MD
;
Dynamical spectra
;
Vibrational anharmonicities
刊名:Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy
出版年:5 February, 2014
3.
MCMC
2
(version 1.1): A Monte Carlo code for multiply-charged clusters
作者:
David A. Bonhommeau
;
Marius Lewerenz
;
Marie
-
Pierre
Gaigeot
关键词:
Monte Carlo simulations
;
Coarse-grained models
;
Charged clusters
;
Charged droplets
;
Electrospray ionisation
;
Parallel Tempering
;
Parallel Charging
刊名:Computer Physics Communications
出版年:March, 2014
4.
Differentiation of the fucoidan sulfated
l-fucose isomers constituents by CE-ESIMS and molecular modeling
作者:
Bé
;
rangè
;
re Tissot
;
Jean-Yves Salpin
;
Michael Martinez
;
Marie
-
Pierre
Gaigeot
and Ré
;
gis Daniel
关键词:
Sulfated fucose
;
Fucoidan
;
ESIMS
;
Capillary electrophoresis
;
Molecular modeling
;
Isomeric structures differentiation
刊名:Carbohydrate Research
出版年:2006
5.
Generating approximate Wigner distributions using Gaussian phase packets propagation in imaginary time
作者:
Dana Codruta Marinica
;
Marie
-
Pierre
Gaigeot
and Daniel Borgis
刊名:Chemical Physics Letters
出版年:2006
6.
Analysis of the structural and vibrational properties of RNA building blocks by means of neutron inelastic scattering and density functional theory calculations
作者:
Gaigeot
;
Marie
-
Pierre
;
Leulliot
;
Nicolas
;
Ghomi
;
Mahmoud
;
Jobic
;
Hervé
;
Coulombeau
;
Christian
;
et. al.
关键词:
Uracil
;
Uridine
;
Cytosine
;
Cytidine
;
Guanine
;
Guanosine
;
Adenine
;
Adenosine
;
Nucleic acids
;
RNA
;
DFT calculations
;
Neutron inelastic scattering
;
Vibrational spectra
;
Force field
;
Molecular modelling
刊名:Chemical Physics
出版年:2000
1
按检索点细分(6)
作者(6)
按出版年细分(6)
2027年及以后(3)
2006年(2)
2000年(1)
NGLC 2004-2010.National Geological Library of China All Rights Reserved.
Add:29 Xueyuan Rd,Haidian District,Beijing,PRC. Mail Add: 8324 mailbox 100083
For exchange or info please contact us via
email
.