Computer Generated Physical Properties

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Computer Generated Physical Properties

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Author : Stan Bumble
language : en
Publisher: CRC Press
Release Date : 1999-06-01

Computer Generated Physical Properties written by Stan Bumble and has been published by CRC Press this book supported file pdf, txt, epub, kindle and other format this book has been release on 1999-06-01 with Science categories.

Computer Generated Physical Properties offers the environmental scientist a basis to predict the properties of molecules and reengineer them to remove those properties that are harmful to the environment. This technology is currently used in other fields and is now becoming popular in the environmental engineering field because of its pollution prevention and waste reduction capabilities. This book, interdisciplinary in scope, treats the physical properties of matter as generated by computers. It covers a wide variety of topics pointing towards synthesizing new molecules to substitute for reactants, intermediaries, and products in industrial processes with better physical and environmental properties than the original. The author achieves this with a spreadsheet program called SYNPROPS that operates on a PC computer with optimization features. A radar type graph - one for each property - visually sorts the various groups in order of their contribution to the property, creating the necessity for a computer to obtain answers for the structure of the optimum molecules for substitution or synthesis. The author discusses applications to biologically active molecules without side effects, including antineoplatic drugs. Additionally, he demonstrates model compounds and the applications of SYNPROPS' optimization and substitution. This book has everything you need to know about deriving properties and combinational chemistry from molecular structure.

Physical Property Prediction In Organic Chemistry

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Author : Clemens Jochum
language : en
Publisher: Springer Science & Business Media
Release Date : 2012-12-06

Physical Property Prediction In Organic Chemistry written by Clemens Jochum and has been published by Springer Science & Business Media this book supported file pdf, txt, epub, kindle and other format this book has been release on 2012-12-06 with Science categories.

For more than 100 years the Beilstein Handbook has been publishing checked and evaluated data on organic compounds. It has become the major reference book for the chemical and physical properties of organic com pounds. The prediction of these physical properties was the subject of the Beilstein workshop. The ability to predict physical properties is for several reasons of great interest to the Beilstein Institute. It is of primary importance to be able to check the abstracted data for accuracy and to eliminate simple mistakes like typing errors. Presently all the work whether manuscript writing or evaluation of data is carried out manually. This is very time consuming, with the entry of Beilstein into electronic data gathering and publication, the opportunity for computerized consistency checking has become available. Contrary to belief, when one examines the Beilstein Handbook or Chemical Abstracts there is a dearth of chemical information. There are a great many compounds but few are well defined resulting in large gaps in the information available to the chemist. These information gaps could be filled by using algorithmic methods to estimate the properties of interest. An important question to answer is "What is the chemist's reaction to estimated data?" Will he accept it for use, within limits defined by the method, or will it be unacceptable and therefore detrimental for the data base. However if one could partly fill gaps in the data base the increase in the power of the search techniques would be marked.

Federal Adp And Telecommunications Standards Index

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Author :
language : en
Publisher:
Release Date : 1990

Federal Adp And Telecommunications Standards Index written by and has been published by this book supported file pdf, txt, epub, kindle and other format this book has been release on 1990 with Administrative agencies categories.

Emerging Digital Forensics Applications For Crime Detection Prevention And Security

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Author : Li, Chang-Tsun
language : en
Publisher: IGI Global
Release Date : 2013-05-31

Emerging Digital Forensics Applications For Crime Detection Prevention And Security written by Li, Chang-Tsun and has been published by IGI Global this book supported file pdf, txt, epub, kindle and other format this book has been release on 2013-05-31 with Law categories.

The revolutionary way in which modern technologies have enabled us to exchange information with ease has led to the emergence of interdisciplinary research in digital forensics and investigations, which aims to combat the abuses of computer technologies. Emerging Digital Forensics Applications for Crime Detection, Prevention, and Security presents various digital crime and forensic disciplines that use electronic devices and software for crime prevention and detection. This book provides theoretical and empirical research articles and case studies for a broad range of academic readers as well as professionals, industry consultants, and practitioners involved in the use, design, and development of techniques related to digital forensics and investigation.

Adp And Telecommunication Standards Index

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Author :
language : en
Publisher:
Release Date : 1990

Adp And Telecommunication Standards Index written by and has been published by this book supported file pdf, txt, epub, kindle and other format this book has been release on 1990 with Electronic data processing categories.

Forthcoming Books

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Author : Rose Arny
language : en
Publisher:
Release Date : 1999

Forthcoming Books written by Rose Arny and has been published by this book supported file pdf, txt, epub, kindle and other format this book has been release on 1999 with American literature categories.

Applied Thermodynamics

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Author : American Chemical Society. Division of Industrial and Engineering Chemistry
language : en
Publisher: American Chemical Society
Release Date : 1968

Applied Thermodynamics written by American Chemical Society. Division of Industrial and Engineering Chemistry and has been published by American Chemical Society this book supported file pdf, txt, epub, kindle and other format this book has been release on 1968 with Science categories.

Soviet Science

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Author :
language : en
Publisher:
Release Date : 1975

Soviet Science written by and has been published by this book supported file pdf, txt, epub, kindle and other format this book has been release on 1975 with Science categories.

High Level Radioactive Waste Management

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Author :
language : en
Publisher:
Release Date : 1992

High Level Radioactive Waste Management written by and has been published by this book supported file pdf, txt, epub, kindle and other format this book has been release on 1992 with Radioactive waste disposal categories.

Annual Report West Virginia Geological And Economic Survey

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Author : West Virginia Geological and Economic Survey
language : en
Publisher:
Release Date : 1987

Annual Report West Virginia Geological And Economic Survey written by West Virginia Geological and Economic Survey and has been published by this book supported file pdf, txt, epub, kindle and other format this book has been release on 1987 with Geology categories.