Computers and Applied Chemistry 2012 Issue 8 Quantum chemistry study on the structure-activity relationship of imidazoline inhibitors

Quantum chemistry study on the structure-activity relationship of imidazoline inhibitors
Chen Jun;Bai Lin;Song Jirong;Ma Haixia

..............page:1009-1013

CFD numerical simulation of the momentum and heat transfer in membrane distillation process
Shao Huisheng;Pan Yanqiu;Yu Lu

..............page:938-942

Simulation of extractive distillation process of ethyl acetate—n-hexane system using aspen plus
Yang Wendong;Yuan Shenfeng;Chen Zhirong;Yin Hong

..............page:955-958

Molecular dynamics simulation of condensation coefficient of argon fluid
Huo Jiajie;Zhang Yu;Lei Guangping;Wang Baohe

..............page:969-972

Rapid qualitative analysis model for cetirizine hydrochloride Tablets by NIR using chemometric methods
Weng Xinxin;Mao Danzhuo;Yang Yongjian

..............page:995-998

An algorithm of medical image enhancement based on dyadic wavelet transform
Eilimnur Abiljan;Abdurusul Osman;Turghunjan;Abdukirim Turki

..............page:951-954

Design of a microfluidic chip based real-time detection system for chemical pollutants
Zou Zhiyun;Liu Xinghong;Zhou Shikun;Zhu Wenchao;Gui Xinjun;Zheng Guozhi

..............page:1014-1018

Predicting and design cationic antimicrobial peptides based on the peptide sequence
Shu Mao;Lu Yakuo;Zhang Yunru;Yang Li;Lin Zhihua

..............page:921-926

ji suan ji yu ying yong hua xue zheng gao jian ze

..............page:954

Computer-aided calibration of coal flow meters in SHELL coal gasification process
Guo Feihong;Lv Wenxiang;Huang Dexian;Yang Yue

..............page:903-906

Numerical simulation of liquid-liquid two-phase flow in an oscillatory baffled reactor
Liu Cheng;Fu Cunting;Zhang Minhua;Geng Zhongfeng

..............page:959-964

The calculation and study of the model on the solution surface tensionand its concentration
Huang Xuezheng;Zhanglei

..............page:991-994

Application of statistica software to optimize synthesized conditions of tetraethylenepentamine polystyrene resin
Wang Yubo;Li Yanzhao;Hao Weiqiang;Sun Xiaoli;Chen Qiang

..............page:918-920

Theoretical study on the structures and IHAT reactions of Corrole and Corrolazine
Liao Yuting;Rao Huoyu;Wang Qiuyue;Hu Baoqun

..............page:947-950

On the rundle circulation and green utilization of the thermal energy from coal gasification
Su Yajie;Liang Wenge;Tian Bo;Zhao Suping;Ye Zepu;Du Yinghu

..............page:986-990

Quantum chemical calculation on the anticancer activity of three kinds of platinum compounds
Wu Zibin;Wang Liheng;Zhang Bin

..............page:977-980

The development and application of a spectrum denoising softwarein teaching instrumental analysis experiment
Deng Xiangdong;Wang Zhiheng;Zhu Zhongliang;Cong Peisheng

..............page:1027-1030

The constructional mode's research of modeling and extensible virtual organic chemistry laboratory
Liu Zhiguang;Jia Jianbo;Zhang Yongce;Lin Lili

..............page:1019-1022

Nolinear simultaneous equation-solving(NSES) method for vapor-liquid equilibrium calculation
Peng Changrong;Liu Qifeng;Liu Zhiguo

..............page:1004-1008

Studies on the structures and performances of Fe/TiO2 photocatalyst
Liu Xiuhua;Meng Dan;Wang Heyi;Deng Yi

..............page:913-917

Numerical simulation of mixing process in a silicone oil emulsion stirred tank with gate impeller
Ni Bangqing;Wang Qiushi;Fan Mingming

..............page:927-932

Simulation of the process of bismuth oxide powders produced by vapor-phase oxidation
Hu Hanxiang;Qiu Keqiang

..............page:933-937

Application of MATLAB in solving adsorption mathematic model of DMF on NKA-Ⅱ resin
Ye Changshen;Li Yanhu;Lin Cheng;Fu Jie

..............page:965-968

Predicting ligand druggability for drug discovery
Li Xiao;Kong Dexin

..............page:999-1003

GPU-based implementation of LINCS constraint algorithm for molecular dynamics simulation
Liu Zhongliang;Li Xiaoxia;Shi Jing;Guo Li;Kong Bin;Yang Xiaozhen

..............page:907-912

Study and practice on teaching principles of bio-reaction engineering using soft of STATISTICA
Mao Yanyong;Li Wenqian;Guo Yingwei

..............page:1023-1026

Study on boiling point of aldehydes and ketones using a new structural descriptor
Qin Song;Liao Limin

..............page:973-976

Chemical target identification method based on euclidean distance
Zheng Rao;Hao Jinling;Wang Yun

..............page:943-946

Two-temperature model of water gas shift reaction in porous media based on FLUENT
Long Huilong;Xu Mingjie;Yu Donghua;Ding Yang;Wang Kefeng

..............page:981-985