Frontiers in Computational Chemistry

Frontiers in Computational Chemistry presents contemporary research on molecular modeling techniques used in drug discovery and the drug development process: computer aided molecular design, drug discovery and development, lead generation, lead optimizati

Produk Detail:

  • Author : Zaheer-Ul-Haq Qasmi
  • Publisher : Anonim
  • Pages : 123 pages
  • ISBN : 9781681081687
  • Rating : 4/5 from 21 reviews
CLICK HERE TO GET THIS BOOKFrontiers in Computational Chemistry

Frontiers in Computational Chemistry

Frontiers in Computational Chemistry
  • Author : Zaheer-Ul-Haq Qasmi,Jeff Madura
  • Publisher : Unknown Publisher
  • Release : 01 January 2017
GET THIS BOOKFrontiers in Computational Chemistry

Frontiers in Computational Chemistry presents contemporary research on molecular modeling techniques used in drug discovery and the drug development process: computer aided molecular design, drug discovery and development, lead generation, lead optimizati

Frontiers in Computational Chemistry: Volume 2

Frontiers in Computational Chemistry: Volume 2
  • Author : Zaheer Ul-Haq,Jeffry D. Madura
  • Publisher : Elsevier
  • Release : 16 December 2015
GET THIS BOOKFrontiers in Computational Chemistry: Volume 2

Frontiers in Computational Chemistry, originally published by Bentham and now distributed by Elsevier, presents the latest research findings and methods in the diverse field of computational chemistry, focusing on molecular modeling techniques used in drug discovery and the drug development process. This includes computer-aided molecular design, drug discovery and development, lead generation, lead optimization, database management, computer and molecular graphics, and the development of new computational methods or efficient algorithms for the simulation of chemical phenomena including analyses of biological

Frontiers in Computational Chemistry: Volume 4

Frontiers in Computational Chemistry: Volume 4
  • Author : Zaheer Ul-Haq,Angela K. Wilson
  • Publisher : Bentham Science Publishers
  • Release : 03 October 2018
GET THIS BOOKFrontiers in Computational Chemistry: Volume 4

Frontiers in Computational Chemistry presents contemporary research on molecular modeling techniques used in drug discovery and the drug development process: computer aided molecular design, drug discovery and development, lead generation, lead optimization, database management, computer and molecular graphics, and the development of new computational methods or efficient algorithms for the simulation of chemical phenomena including analyses of biological activity. The fourth volume of this series features four chapters covering natural lead compounds, computer aided drug discovery methods in Parkinson’s

Frontiers in Computational Chemistry: Volume 5

Frontiers in Computational Chemistry: Volume 5
  • Author : Zaheer-Ul-Haq,Angela K. Wilson
  • Publisher : Bentham Science Publishers
  • Release : 11 September 2020
GET THIS BOOKFrontiers in Computational Chemistry: Volume 5

Frontiers in Computational Chemistry presents contemporary research on molecular modeling techniques used in drug discovery and the drug development process: computer aided molecular design, drug discovery and development, lead generation, lead optimization, database management, computer and molecular graphics, and the development of new computational methods or efficient algorithms for the simulation of chemical phenomena including analyses of biological activity. The fifth volume of this series features these six chapters: - Recent Advances and Role of Computational Chemistry in Drug Designing

Frontiers in Computational Chemistry: Volume 1

Frontiers in Computational Chemistry: Volume 1
  • Author : Zaheer Ul-Haq,Jeffry D. Madura
  • Publisher : Elsevier
  • Release : 14 December 2015
GET THIS BOOKFrontiers in Computational Chemistry: Volume 1

Frontiers in Computational Chemistry, originally published by Bentham and now distributed by Elsevier, presents the latest research findings and methods in the diverse field of computational chemistry, focusing on molecular modeling techniques used in drug discovery and the drug development process. This includes computer-aided molecular design, drug discovery and development, lead generation, lead optimization, database management, computer and molecular graphics, and the development of new computational methods or efficient algorithms for the simulation of chemical phenomena including analyses of biological

Frontiers in Computational Chemistry

Frontiers in Computational Chemistry
  • Author : Zaheer-Ul-Haq Qasmi,Jeff Madura
  • Publisher : Unknown Publisher
  • Release : 28 October 2021
GET THIS BOOKFrontiers in Computational Chemistry

Annotation Frontiers in Computational Chemistry presents contemporary research on molecular modeling techniques used in drug discovery and the drug development process: computer aided molecular design, drug discovery and development, lead generation, lead optimization, database management, computer and molecular graphics, and the development of new computational methods or efficient algorithms for the simulation of chemical phenomena including analyses of biological activity. The Second volume of this series features nine different articles covering topics such as antibacterial drug discovery, high throughput screening,

Frontiers in Computational Chemistry

Frontiers in Computational Chemistry
  • Author : Zaheer Ul-Haq,Jeffry D. Madura
  • Publisher : Bentham Science Publishers
  • Release : 22 February 2017
GET THIS BOOKFrontiers in Computational Chemistry

Frontiers in Computational Chemistry presents contemporary research on molecular modeling techniques used in drug discovery and the drug development process: computer aided molecular design, drug discovery and development, lead generation, lead optimization, database management, computer and molecular graphics, and the development of new computational methods or efficient algorithms for the simulation of chemical phenomena including analyses of biological activity. The third volume of this series features four chapters covering in silico approaches to computer aided drug design, modeling of platinum

Frontiers in Computational Chemistry Volume 5

Frontiers in Computational Chemistry Volume 5
  • Author : Zaheer Ul-Haq Qasmi
  • Publisher : Unknown Publisher
  • Release : 11 September 2020
GET THIS BOOKFrontiers in Computational Chemistry Volume 5

Frontiers in Computational Chemistry presents contemporary research on molecular modeling techniques used in drug discovery and the drug development process: computer aided molecular design, drug discovery and development, lead generation, lead optimization, database management, computer and molecular graphics, and the development of new computational methods or efficient algorithms for the simulation of chemical phenomena including analyses of biological activity. The fifth volume of this series features these six chapters: - Recent Advances and Role of Computational Chemistry in Drug Designing

Frontiers in Computational Chemistry

Frontiers in Computational Chemistry
  • Author : Zaheer Ul-Haq,Jeffry D. Madura
  • Publisher : Unknown Publisher
  • Release : 01 January 2015
GET THIS BOOKFrontiers in Computational Chemistry

"Frontiers in Computational Chemistry," originally published by Bentham and now distributed by Elsevier, presents the latest research findings and methods in the diverse field of computational chemistry, focusing on molecular modeling techniques used in drug discovery and the drug development process. This includes computer-aided molecular design, drug discovery and development, lead generation, lead optimization, database management, computer and molecular graphics, and the development of new computational methods or efficient algorithms for the simulation of chemical phenomena including analyses of biological

Frontiers in Computational Chemistry

Frontiers in Computational Chemistry
  • Author : Zaheer-Ul-Haq Qasmi,Jeff Madura
  • Publisher : Unknown Publisher
  • Release : 28 October 2021
GET THIS BOOKFrontiers in Computational Chemistry

Annotation Computational chemistry is a very diverse field spanning from the development and application of linear free energy relationships (QSAR, QSPR), to electronic structure calculations, molecular dynamics simulations, and to solving coupled differential equations (e.g. drug metabolism). Frontiers in Computational Chemistry presents contemporary research on molecular modeling techniques used in drug discovery and the drug development process: computer aided molecular design, drug discovery and development, lead generation, lead optimization, database management, computer and molecular graphics, and the development of

Frontiers in Chemistry: Rising Stars

Frontiers in Chemistry: Rising Stars
  • Author : Steve Suib,Huangxian Ju,Serge Cosnier,Bunsho Ohtani,John D. Wade,Gil Garnier,Nosang Vincent Myung,Luís D. Carlos,Michael Kassiou,Fan Zhang,Iwao Ojima,Pellegrino Musto,Tony D. James,Thomas S. Hofer,Sam P. De Visser
  • Publisher : Frontiers Media SA
  • Release : 17 April 2020
GET THIS BOOKFrontiers in Chemistry: Rising Stars

The Frontiers in Chemistry Editorial Office team are delighted to present the inaugural “Frontiers in Chemistry: Rising Stars” article collection, showcasing the high-quality work of internationally recognized researchers in the early stages of their independent careers. All Rising Star researchers featured within this collection were individually nominated by the Journal’s Chief Editors in recognition of their potential to influence the future directions in their respective fields. The work presented here highlights the diversity of research performed across the entire

Advances in Density Functional Theory

Advances in Density Functional Theory
  • Author : Anonim
  • Publisher : Academic Press
  • Release : 27 October 1998
GET THIS BOOKAdvances in Density Functional Theory

Quantum mechanics can describe the detailed structure and behavior of matter, from electrons, atoms, and molecules, to the whole universe. It is one of the fields of knowledge that yield extraordinary precessions, limited only by the computational resources available. Among these methods is density functional theory (DFT), which permits one to solve the equations of quantum mechanics more efficiently than with any related method. The present volume represents the most comprehensive summary currently available in density functional theory and its

Quantum Mechanical/Molecular Mechanical Approaches for the Investigation of Chemical Systems – Recent Developments and Advanced Applications

Quantum Mechanical/Molecular Mechanical Approaches for the Investigation of Chemical Systems – Recent Developments and Advanced Applications
  • Author : Thomas S. Hofer,Sam P. de Visser
  • Publisher : Frontiers Media SA
  • Release : 28 November 2018
GET THIS BOOKQuantum Mechanical/Molecular Mechanical Approaches for the Investigation of Chemical Systems – Recent Developments and Advanced Applications

The QM/MM method, short for quantum mechanical/molecular mechanical, is a highly versatile approach for the study of chemical phenomena, combining the accuracy of quantum chemistry to describe the region of interest with the efficiency of molecular mechanical potentials to represent the remaining part of the system. Originally conceived in the 1970s by the influential work of the the Nobel laureates Martin Karplus, Michael Levitt and Arieh Warshel, QM/MM techniques have evolved into one of the most accurate

Molecular Dynamics and Machine Learning in Drug Discovery

Molecular Dynamics and Machine Learning in Drug Discovery
  • Author : Sergio Decherchi,Andrea Cavalli,Pratyush Tiwary,Francesca Grisoni
  • Publisher : Frontiers Media SA
  • Release : 08 June 2021
GET THIS BOOKMolecular Dynamics and Machine Learning in Drug Discovery

Dr. Sergio Decherchi and Dr. Andrea Cavalli are co-founders of BiKi Technologies s.r.l. - a company that commercializes a Molecular Dynamics-based software suite for drug discovery. All other Topic Editors declare no competing interests with regards to the Research Topic subject.