2018

[429]

Cuicui Wang, Wensheng Cai, Xueguang Shao

 

Experimental and chemometric optimization to enhance the performance of near-infrared diffuse reflectance spectroscopy

 

Analytical Letters, 2018, 51(4): 537-546

[430]

Haohao Fu, James C. Gumbart, Haochuan Chen, Xueguang Shao, Wensheng Cai, Christophe Chipot

 

 

BFEE: A User-Friendly Graphical Interface Facilitating Absolute Binding Free-Energy Calculations

 

 

Journal of Chemical Information and Modeling, 2018, 58(3): 556-560

 

[431]

Dan Cheng, Wensheng Cai, Xueguang Shao

 

 

Understanding the Interaction Between Oligopeptide and Water in Aqueous Solution Using Temperature-Dependent Near-Infrared Spectroscopy

 

 

Applied spectroscopy, 2018, 3702818769410 (DOI:10.1177/0003702818769410)

 

[432]

Shuangli Du, Haohao Fu, Xueguang Shao, Christophe Chipot, Wensheng Cai

 

 

Water-Controlled Switching in Rotaxanes

 

 

Journal of Physical Chemistry C, 2018, 122(16) : 9229-9234

 

[433]

Xueguang Shao, Xiaoyu Cui, Xiaoming Yu, Wensheng Cai

 

 

Mutual factor analysis for quantitative analysis by temperature dependent near infrared spectra

 

 

Talanta, 2018, 183: 142–148