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Structure-based drug design

Record Type:	Electronic resources : Monograph/item
Title/Author:	Structure-based drug design/ edited by Marcelo A. Marti, Adrian Gustavo Turjanski, Dario Fernández Do Porto.
other author:	Marti, Marcelo.
Published:	Cham :Springer International Publishing : : 2024.,
Description:	ix, 256 p. :ill. (chiefly color), digital ;24 cm.
[NT 15003449]:	Prioritizing Drug Targets in Pathogenic Bacteria by Harnessing Structural Biology, Metabolic Analysis, and Omics Data Integration -- Regulatory small RNAs as antimicrobial drug targets -- Riboswitches as antimicrobial targets -- Pre-selection of compounds for lead identification in virtual screening campaigns -- Docking and Bias Docking -- Molecular Dynamics and its Significance in Drug Discovery -- Deep Learning Strategies for Enhanced Molecular Docking and Virtual Screening -- Integrating computational approaches from non-synonymous sequence variations to molecular structure for drug repositioning targeting the SARS-CoV-2 Spike protein.
Contained By:	Springer Nature eBook
Subject:	Drugs - Design. -
Online resource:	https://doi.org/10.1007/978-3-031-69162-1
ISBN:	9783031691621

Structure-based drug design
Structure-based drug design[electronic resource] /edited by Marcelo A. Marti, Adrian Gustavo Turjanski, Dario Fernández Do Porto. - Cham :Springer International Publishing :2024. - ix, 256 p. :ill. (chiefly color), digital ;24 cm. - Computer-aided drug discovery and design,v. 22730-5465 ;. - Computer-aided drug discovery and design ;v. 2..

Prioritizing Drug Targets in Pathogenic Bacteria by Harnessing Structural Biology, Metabolic Analysis, and Omics Data Integration -- Regulatory small RNAs as antimicrobial drug targets -- Riboswitches as antimicrobial targets -- Pre-selection of compounds for lead identification in virtual screening campaigns -- Docking and Bias Docking -- Molecular Dynamics and its Significance in Drug Discovery -- Deep Learning Strategies for Enhanced Molecular Docking and Virtual Screening -- Integrating computational approaches from non-synonymous sequence variations to molecular structure for drug repositioning targeting the SARS-CoV-2 Spike protein.

This volume focuses on target-oriented approximations to drug discovery, including target selection, binding pocket detection, and current uses and variants of molecular dynamics and molecular docking. The primary audience is PhD and graduates working in the field of molecular biology, structural biology, pharmaceutical sciences.

ISBN: 9783031691621

Standard No.: 10.1007/978-3-031-69162-1doiSubjects--Topical Terms:

664528
Drugs
--Design.

LC Class. No.: RS420

Dewey Class. No.: 615.19

Structure-based drug design
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245 0 0 $a Structure-based drug design $h [electronic resource] / $c edited by Marcelo A. Marti, Adrian Gustavo Turjanski, Dario Fernández Do Porto.
260 $a Cham : $c 2024. $b Springer International Publishing : $b Imprint: Springer,
300 $a ix, 256 p. : $b ill. (chiefly color), digital ; $c 24 cm.
490 1 $a Computer-aided drug discovery and design, $x 2730-5465 ; $v v. 2
505 0 $a Prioritizing Drug Targets in Pathogenic Bacteria by Harnessing Structural Biology, Metabolic Analysis, and Omics Data Integration -- Regulatory small RNAs as antimicrobial drug targets -- Riboswitches as antimicrobial targets -- Pre-selection of compounds for lead identification in virtual screening campaigns -- Docking and Bias Docking -- Molecular Dynamics and its Significance in Drug Discovery -- Deep Learning Strategies for Enhanced Molecular Docking and Virtual Screening -- Integrating computational approaches from non-synonymous sequence variations to molecular structure for drug repositioning targeting the SARS-CoV-2 Spike protein.
520 $a This volume focuses on target-oriented approximations to drug discovery, including target selection, binding pocket detection, and current uses and variants of molecular dynamics and molecular docking. The primary audience is PhD and graduates working in the field of molecular biology, structural biology, pharmaceutical sciences.
650 0 $a Drugs $x Design. $3 664528
650 1 4 $a Biomedical Research. $3 851895
650 2 4 $a Pharmacology. $3 634543
650 2 4 $a Structure-Based Drug Design. $3 3538435
650 2 4 $a Pharmaceutics. $3 3538434
650 2 4 $a Pharmacy. $3 636101
700 1 $a Marti, Marcelo. $3 3733181
700 1 $a Turjanski, Adrian Gustavo. $3 3733182
700 1 $a Do Porto, Dario Fernández. $3 3733183
710 2 $a SpringerLink (Online service) $3 836513
773 0 $t Springer Nature eBook
830 0 $a Computer-aided drug discovery and design ; $v v. 2. $3 3733184
856 4 0 $u https://doi.org/10.1007/978-3-031-69162-1
950 $a Biomedical and Life Sciences (SpringerNature-11642)