Influence of Chirality of Crizotinib on Its MTH1 Protein Inhibitory Activity: Insight from Molecular Dynamics Simulations and Binding Free Energy Calculations.
about
Revealing inhibition difference between PFI-2 enantiomers against SETD7 by molecular dynamics simulations, binding free energy calculations and unbinding pathway analysis.Understanding the molecular mechanism for the differential inhibitory activities of compounds against MTH1.The binding mechanism between azoles and FgCYP51B, sterol 14α-demethylase of Fusarium graminearum.(S)-crizotinib reduces gastric cancer growth through oxidative DNA damage and triggers pro-survival akt signal.Insight into the substrate specificity change caused by the Y227H mutation of α-glucosidase III from the European honeybee (Apis mellifera) through molecular dynamics simulations.
P2860
Influence of Chirality of Crizotinib on Its MTH1 Protein Inhibitory Activity: Insight from Molecular Dynamics Simulations and Binding Free Energy Calculations.
description
2015 nî lūn-bûn
@nan
2015年の論文
@ja
2015年論文
@yue
2015年論文
@zh-hant
2015年論文
@zh-hk
2015年論文
@zh-mo
2015年論文
@zh-tw
2015年论文
@wuu
2015年论文
@zh
2015年论文
@zh-cn
name
Influence of Chirality of Criz ...... ding Free Energy Calculations.
@ast
Influence of Chirality of Criz ...... ding Free Energy Calculations.
@en
type
label
Influence of Chirality of Criz ...... ding Free Energy Calculations.
@ast
Influence of Chirality of Criz ...... ding Free Energy Calculations.
@en
prefLabel
Influence of Chirality of Criz ...... ding Free Energy Calculations.
@ast
Influence of Chirality of Criz ...... ding Free Energy Calculations.
@en
P2093
P2860
P1433
P1476
Influence of Chirality of Criz ...... ding Free Energy Calculations.
@en
P2093
Danfeng Shi
Huanxiang Liu
Xiaojun Yao
Yuzhen Niu
P2860
P304
P356
10.1371/JOURNAL.PONE.0145219
P407
P50
P577
2015-12-17T00:00:00Z