Machine Learning in Chemistry

Machine Learning in Chemistry

Author: Jon Paul Janet

Publisher: American Chemical Society

Published: 2020-05-28

Total Pages: 189

ISBN-13: 0841299005

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Recent advances in machine learning or artificial intelligence for vision and natural language processing that have enabled the development of new technologies such as personal assistants or self-driving cars have brought machine learning and artificial intelligence to the forefront of popular culture. The accumulation of these algorithmic advances along with the increasing availability of large data sets and readily available high performance computing has played an important role in bringing machine learning applications to such a wide range of disciplines. Given the emphasis in the chemical sciences on the relationship between structure and function, whether in biochemistry or in materials chemistry, adoption of machine learning by chemistsderivations where they are important


Ionization Potentials

Ionization Potentials

Author: L. H. Ahrens

Publisher: Elsevier

Published: 2013-10-22

Total Pages: 117

ISBN-13: 1483154777

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Ionization Potentials: Some Variations, Implications and Applications covers several aspects of ionization potential that is a highly significant parameter in controlling the properties of electric discharge. Comprised of 17 chapters, the book covers topic relevant to ionization potentials, such as properties, concepts, and applications, in order to understand and fully comprehend all aspects of ionization potential. The opening chapter is a review of ionization potentials and a discussion of trends and features. The succeeding chapters then tackle complex topics such as the s and p electrons; d-transition elements; rare earth elements; screening (shielding); inert elements; cationic forces (polarizing power); and heats of hydration. This book will appeal to researchers from different fields.


On Being Well-coordinated: A Half-century Of Research On Transition Metal Complexes

On Being Well-coordinated: A Half-century Of Research On Transition Metal Complexes

Author: John L Burmeister

Publisher: World Scientific

Published: 2003-10-14

Total Pages: 654

ISBN-13: 9814488003

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This invaluable book distils the research accomplishments of Professor Fred Basolo during the five decades when he served as a world leader in the modern renaissance of inorganic chemistry. Its primary focus is on the very important area of chemistry known as coordination chemistry.Most of the elements in the periodic table are metals, and most of the chemistry of metals involves coordination chemistry. This is the case in the currently significant areas of research, including organometallic homogenous catalysis, biological reactions of metalloproteins, and even the solid state extended structures of new materials. In these systems, the metals are of primary importance because they are the sites of ligand substitution or redox reactions. In the solid materials, the coordination number of the metal and its stereochemistry are of major importance.Some fifty years of research on transition metal complexes carried out in the laboratory of Professor Basolo at Northwestern University is recorded here as selected scientific publications. The book is divided into three different major research areas, each dealing with some aspect of coordination chemistry. In each case, introductory remarks are presented which indicate what prompted the research projects and what the major accomplishments were. Although the research was of the academic, curiosity-driven type, some aspects have proven to be useful to others involved in projects that were much more applied in nature.


Pyridine

Pyridine

Author: Pratima Parashar Pandey

Publisher: BoD – Books on Demand

Published: 2018-07-18

Total Pages: 86

ISBN-13: 1789234220

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This book is designed and styled in order to give researchers a vast horizon about pyridine. A deep look in the structural analysis of pyridine provides a base for all the building blocks derived from it and its applications. Pyridines and pyridine moieties are found in many natural products, such as vitamins, coenzymes, alkaloids, many drugs, and pesticides. The book is divided into three parts: the first takes to the introduction, the second part deals with composition of various compounds using heterocyclic ring of pyridine, and the third part discusses about applications of pyridine compounds.


The Chemistry of Organocopper Compounds

The Chemistry of Organocopper Compounds

Author: Zvi Rappoport

Publisher: John Wiley & Sons

Published: 2009-12-21

Total Pages: 1183

ISBN-13: 0470772964

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Copper in organic synthesis has seen a tremendous development over the past ten years. This text represents the most comprehensive survey on the use of Copper and Cuprates in organic synthesis. The first time that the Patai Series touches on Copper compounds, it contains contributions by leading experts, and delivers the quality expected from the Patai Series.


Emerging Trends of Research in Chemical Sciences

Emerging Trends of Research in Chemical Sciences

Author: Tanmoy Chakraborty

Publisher: CRC Press

Published: 2021-09-08

Total Pages: 182

ISBN-13: 1000290891

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Here is a compilation of the research being done by scientists from various disciplines of chemistry at universities across the globe. This new volume provides a wealth of practical experience and research on new methodologies and important applications in chemical science. It also includes presentations on small-scale new drug design related projects that have potential applications in several disciplines of chemistry and in drug development. In this book, contributions range from new methods to novel applications of existing methods to enhance understanding of the material and/or structural behavior of new and advanced systems. Topics cover computational methods in chemical sciences and electrochemical investigations; studies of some of physico-chemical properties of several important novel macrocyclic ligands; the use of lanthanide-ions doped nanomaterials; quantitative estimation of heavy metals, a sustainable, efficient and green promoter for the synthesis of some heterocyclic compounds; and much more.


Current Research Topics in Bioinorganic Chemistry, Volume 18

Current Research Topics in Bioinorganic Chemistry, Volume 18

Author: Stephen J. Lippard

Publisher: John Wiley & Sons

Published: 2009-09-17

Total Pages: 466

ISBN-13: 047016669X

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This comprehensive series of volumes on inorganic chemistry provides inorganic chemists with a forum for critical, authoritative evaluations of advances in every area of the discipline. Every volume reports recent progress with a significant, up-to-date selection of papers by internationally recognized researchers, complemented by detailed discussions and complete documentation. Each volume features a complete subject index and the series includes a cumulative index as well.


Synthetic Multidentate Macrocyclic Compounds

Synthetic Multidentate Macrocyclic Compounds

Author: Reed Izatt

Publisher: Elsevier

Published: 2012-12-02

Total Pages: 335

ISBN-13: 0323155480

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Synthetic Multidentate Macrocyclic Compounds attempts to bring together selected chapters in which the authors discuss in depth investigations in important areas of macrocycle research. The chapters deal mainly with macrocyclic compounds (saturated polyethers and their derivatives), and macrobicyclic compounds (cryptates). The book contains six chapters and opens with a first-hand account of the initial synthesis of the cyclic polyethers. This is followed by separate chapters on the synthesis of cyclic polyethers, polyether amines, and polyether sulfides; the synthesis of multidentate compounds; and the structure of synthetic macrocyclic compounds and their cation complexes. Subsequent chapters deal with the rates of reactions and the mechanism by which synthetic macrocyclic ligands complex substrates in solution; and commercial applications of the synthetic macrocyclic ligands. This book is primarily aimed at researchers and students in organic, physical, analytical, and inorganic chemistry, and in chemical engineering. However, it will also be of interest to many in the areas of biology, biochemistry, and physiology. Extensive literature references are found in each chapter.