1 Computer literature retrieval
1.1 Chemical and chemical information resources on the Internet 1
1.2 Searching chemical and chemical information through Internet search engines 1
1.2.1 Google 1
1.2.2 Baidu 3
1.3 Retrieval of chemical and chemical literature database 5
1.3.1 China periodical full-text database. 3.2 engineering index EI 9
1.3.3 scientific citation index SCI 1
1.3.4 Elsevier database 13
1.3.5 Wiley InterScience database 15
1.3.6 American Chemical Society (ACS) periodical database 15
1.3.7 other literature database 15. > 1.4.1 patent, Patent literature and patent specification 17
1.4.2 derwent World Patent Innovation Index 18
1.4.3 China Patent Retrieval 18
1.4.4 American Patent Retrieval 18
1.5 Physical property database on the Internet 21
1.5.1 Physical property database of National Institute of Standards and Technology (NIST) 21 < A query interface
CS ChemFinder 21
1.5.3 solvent database SOLV-DB 21
1.5.4 website of international chemical reagent supplier
Aldrich 21
1.6 online chemical and chemical standards 22
1.6.1 China standard service network 22
1.6. The navigation site 22
2 computer literature management 23
2.1 Introduction to EndNote 23
2.2 Establishment of Endnote Database 23
2.3 Entry of Literature 24
2.3.1 Manual Entry 24
2.3.2 Online Direct Retrieval 25
2.3.3 Download and import from network database. 33
2.4.1 Insert and arrange references in Word 33
2.4.2 EndNote style 35
2.4.3 Write papers with paper templates 35
Exercise 37
3 Orthogonal experiment design 38
3.1 Basic concepts of orthogonal experiment 38
. 39
3.1.3 Mixed orthogonal table 4
3.2 Orthogonal test design 4
3.3 Data processing of orthogonal test 42
3.3.1 Visual analysis of orthogonal test data 43
3.3.2 Variance analysis of orthogonal test data 46
3.4 Application of Excel in orthogonal test data processing 48 <
3.4.2 Application of Excel in data processing of orthogonal test 49
Exercise 52
4 Chemical editing and typesetting 53
4.1 Introduction of chemdraw ACD/ChemSketch
53
4.1.1 ACD/ Introduction to ChemSketch 53
4.1.2 structural model and drawing model 53
4.2 molecular structure drawing 55
4.2.1 simple molecular structure drawing 55
4.2.2 complex molecular structure drawing 59
4.2.3 chemical reaction formula drawing 62
4.3 graph drawing. Macroscopic properties of compounds 64
4.5 Introduction to other important chemical drawing softwares 65
4.5.1 ChemOffice and ChemOffice 65
4.5.2 Chemwindow 66
4.5.3 ISIS Draw 67
Exercise 67
5 Graphic processing of experimental data 69
. Basic knowledge 69
5.1.1 Origin main interface 69
5.1.2 Origin project file 69
5.1.3 Origin sub-window 7
5.2 Data entry 71
5.2.1 Manual input 71
5.2.2 Transfer through the clipboard. P>5.3.1 single-layer two-dimensional graphics 72
5.3.2 multi-layer two-dimensional graphics 73
5.3.3 graphic customization 74
5.3.4 three-dimensional graphics 77
5.4 graphic output 79
5.4.1 output 79
5.4 through the clipboard. 5.5.2 Polynomial fitting 81
5.5.3 Other nonlinear fitting 81
5.5.4 User-defined function fitting 82
Exercise 85
6 Drawing chemical and chemical graphics with Visio 27 86
6.1.1 Introduction to Visio 27 86
6.1.2 graphics. P>6.1.4 application of layers 94
6.2 drawing of chemical process flow chart 95
6.2.1 applying process flow chart template to create new drawings 95
6.2.2 adding equipment, Piping and Valves 95
6.2.3 Adding Instruments and Annotations 97
6.2.4 Drawing Process Flowchart 97
6.3 Drawing Chemical Equipment 15
6.3.1 Determining Sheet and Scale 15
6.3.2 Drawing Arrangement 15
6.3. Technical requirements 16
Exercise 111
7 Matlab and Chemical Engineering Calculation 113
7.1 Basic knowledge of MATLAB 113
7.1.1 Introduction to MATLAB 113
7.1.2 Interface of MATLAB 113
7.1.3 Help function of MATLAB 113
7.2 Linear equations. 2.1 general form of linear equations 116
7.2.2 Judgment of solutions of linear equations 116
7.2.3 Direct solution of linear equations 117
7.3 Data interpolation 119
7.3.1 Introduction to data interpolation 119
7.3.2 Interpolation methods 12
7. Solving equations (groups) 124
7.4.1 Numerical solution of nonlinear equations (groups) 124
7.4.2 Solving nonlinear equations (groups) 125
7.5 Numerical solution of ordinary differential equations (groups) 128
7.5.1 Ordinary differential equations in chemical industry (using Matlab) Using Matlab to solve ordinary differential equations (groups) 132
Exercise 136
8 Excel and chemical optimization problem 137
8.1 Chemical optimization problem 137
8.1.1 Proposing chemical optimization problem 137
8.1.2 Several concepts of chemical optimization problem 138
8.1.3 Chemical industry. Sexual planning 139
8.2.1 Basic theory of linear programming 139
8.2.2 Common solving methods of linear programming problems 141
8.2.3 Excel programming solving tools 142
8.2.4 Using Excel programming solving tools to solve linear programming problems 143
8.3 Nonlinear programming 149
. 15
8.3.2 Numerical solution of nonlinear programming problem 152
8.3.3 Solving nonlinear programming problem with Excel 152
Exercise 153
9 Chemical process simulation 155
9.1 Chemical process simulation technology 155
9.1.1 Brief introduction of chemical process simulation technology 155
2 basic operation of Aspen Plus 156
9.2.1 introduction of Aspen Plus software 156
9.2.2 user interface of aspen plus 157
9.2.3 general steps of process simulation using aspen plus 158
9.3 application example of process simulation using aspen plus 159
9. 3.1 simulation of flash unit 159
9.3.2 design of C2 component distillation separation process 164
9.3.3 simulation of complex process 174
9.4 computational fluid dynamics 176
9.4.1 introduction to CFD 176
9.4.2 basic steps of CFD simulation 177
9. > 1 application of computer in writing and speaking of scientific papers 179
1.1 scientific papers 179
1.1.1 Introduction of scientific papers 179
1.1.2 Basic structure of scientific papers 179
1.1.3 Academic papers published in periodicals 18
1.1.4 Dissertations.
1.2 Application of Microsoft Word in Paper Writing 182
1.2.1 User Interface of Microsoft Word 27 182
1.2.2 Basic Operation of Microsoft Word 183
1.2.3 Writing Papers with Microsoft Word 198
1.3 Pow. The application of erPoint in making slides 199
1.3.1 User interface of PowerPoint 199
1.3.2 Basic operation of PowerPoint 199
Appendix I Matlab application foundation 27
1.1 Data type and calculation function of MATLAB 27
1.1 Variables and constants 27
1.1. .2 Numbers, Operation and format of variables 27
1.1.3 string and its operation 28
1.1.4 matrix and its operation 21
1.2 management of variables and workspace 219
1.2.1 search of variables 219
1.2.2 saving and reading of variables 219
1. 221
1.3.1 Operation command of graphics window and subgraph 221
1.3.2 Two-dimensional graphics drawing command 222
1.3.3 Three-dimensional graphics drawing command 224
Appendix II Examples of academic paper writing specifications 229
II.1 Introduction to a journal 229
II.2 An institute.