Molecular dynamics simulations of ligand dissociation from thyroid hormone receptors: evidence of the likeliest escape pathway and its implications for the design of novel ligands.
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TSH and Thyrotropic Agonists: Key Actors in Thyroid HomeostasisStructural basis of GC-1 selectivity for thyroid hormone receptor isoformsGaining ligand selectivity in thyroid hormone receptors via entropyIdentification of a new hormone-binding site on the surface of thyroid hormone receptorSteered molecular dynamics simulations reveal the likelier dissociation pathway of imatinib from its targeting kinases c-Kit and AblCHARMM Force Field Parameterization of Peroxisome Proliferator-Activated Receptor γ LigandsForced unbinding of GPR17 ligands from wild type and R255I mutant receptor models through a computational approach.Ligand dissociation from estrogen receptor is mediated by receptor dimerization: evidence from molecular dynamics simulationsUnderstanding nuclear receptors using computational methods.Computational estimation of rainbow trout estrogen receptor binding affinities for environmental estrogens.Analysis of agonist and antagonist effects on thyroid hormone receptor conformation by hydrogen/deuterium exchange.Force and Stress along Simulated Dissociation Pathways of Cucurbituril-Guest SystemsPrioritizing Hits with Appropriate Trade-Offs Between HIV-1 Reverse Transcriptase Inhibitory Efficacy and MT4 Blood Cells Toxicity Through Desirability-Based Multiobjective Optimization and Ranking.Mapping allostery through computational glycine scanning and correlation analysis of residue-residue contactsDifferential effects of TR ligands on hormone dissociation rates: evidence for multiple ligand entry/exit pathways.Dynamics of nuclear receptor Helix-12 switch of transcription activation by modeling time-resolved fluorescence anisotropy decays.Nuclear receptor full-length architectures: confronting myth and illusion with high resolution.Thyroid hormone receptor localization in target tissues.Solution Nuclear Magnetic Resonance Studies of the Ligand-Binding Domain of an Orphan Nuclear Receptor Reveal a Dynamic Helix in the Ligand-Binding Pocket.Extracting ligands from receptors by reversed targeted molecular dynamics.
P2860
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P2860
Molecular dynamics simulations of ligand dissociation from thyroid hormone receptors: evidence of the likeliest escape pathway and its implications for the design of novel ligands.
description
2006 nî lūn-bûn
@nan
2006年の論文
@ja
2006年学术文章
@wuu
2006年学术文章
@zh
2006年学术文章
@zh-cn
2006年学术文章
@zh-hans
2006年学术文章
@zh-my
2006年学术文章
@zh-sg
2006年學術文章
@yue
2006年學術文章
@zh-hant
name
Molecular dynamics simulations ...... r the design of novel ligands.
@en
Molecular dynamics simulations ...... r the design of novel ligands.
@nl
type
label
Molecular dynamics simulations ...... r the design of novel ligands.
@en
Molecular dynamics simulations ...... r the design of novel ligands.
@nl
prefLabel
Molecular dynamics simulations ...... r the design of novel ligands.
@en
Molecular dynamics simulations ...... r the design of novel ligands.
@nl
P356
P1476
Molecular dynamics simulations ...... r the design of novel ligands.
@en
P2093
Igor Polikarpov
P356
10.1021/JM050805N
P407
P577
2006-01-01T00:00:00Z