Tackling the challenges posed by target flexibility in drug design.

Tackling the challenges posed by target flexibility in drug design.

Item
http://www.wikidata.org/entity/Q30419540
Insights into Protein-Ligand Interactions: Mechanisms, Models, and MethodsModelling three-dimensional protein structures for applications in drug design.Utilizing experimental data for reducing ensemble size in flexible-protein docking.ReFlexIn: a flexible receptor protein-ligand docking scheme evaluated on HIV-1 proteasePerspectives on the simulation of protein-surface interactions using empirical force field methods.Efficient incorporation of protein flexibility and dynamics into molecular docking simulationsAccelerated flexible protein-ligand docking using Hamiltonian replica exchange with a repulsive biasing potentialInduced fit docking, and the use of QM/MM methods in dockingMolecular motions in drug design: the coming age of the metadynamics method.In silico fragment-based drug design.Understanding the challenges of protein flexibility in drug design.Simulated annealing molecular dynamics and ligand-receptor contacts analysis for pharmacophore modeling.Receptor-ligand molecular docking.Future De Novo Drug Design.The use of docking-based comparative intermolecular contacts analysis to identify optimal docking conditions within glucokinase and to discover of new GK activators.Combining molecular dynamics simulation and ligand-receptor contacts analysis as a new approach for pharmacophore modeling: beta-secretase 1 and check point kinase 1 as case studies.Efficient inclusion of receptor flexibility in grid-based protein-ligand docking.
P2860

Tackling the challenges posed by target flexibility in drug design.

Item
http://www.wikidata.org/entity/Q30419540
description
2010 nî lūn-bûn
@nan
2010 թուականի Ապրիլին հրատարակուած գիտական յօդուած
@hyw
2010 թվականի ապրիլին հրատարակված գիտական հոդված
@hy
2010年の論文
@ja
2010年論文
@yue
2010年論文
@zh-hant
2010年論文
@zh-hk
2010年論文
@zh-mo
2010年論文
@zh-tw
2010年论文
@wuu
name
Tackling the challenges posed by target flexibility in drug design.
@ast
Tackling the challenges posed by target flexibility in drug design.
@en
type
label
Tackling the challenges posed by target flexibility in drug design.
@ast
Tackling the challenges posed by target flexibility in drug design.
@en
prefLabel
Tackling the challenges posed by target flexibility in drug design.
@ast
Tackling the challenges posed by target flexibility in drug design.
@en
P1433
P1476
P2093
P2860
P304
P31
P356
P407
P433
P478
P50
P577
P698
P356
P1433
P1476
Tackling the challenges posed by target flexibility in drug design.
@en
P2093
P2860
P304
P31
P356
P407
P433
P478
P50
P577
P698