CYP 2D6 binding affinity predictions using multiple ligand and protein conformations.
about
Molecular dynamics of CYP2D6 polymorphisms in the absence and presence of a mechanism-based inactivator reveals changes in local flexibility and dominant substrate access channelsLinear Interaction Energy Based Prediction of Cytochrome P450 1A2 Binding Affinities with Reliability EstimationThe eTOX data-sharing project to advance in silico drug-induced toxicity predictionComprehensive and Automated Linear Interaction Energy Based Binding-Affinity Prediction for Multifarious Cytochrome P450 Aromatase InhibitorsImproving the iterative Linear Interaction Energy approach using automated recognition of configurational transitions.Towards automated binding affinity prediction using an iterative linear interaction energy approach.eTOX ALLIES: an automated pipeLine for linear interaction energy-based simulations.Binding free energy predictions of farnesoid X receptor (FXR) agonists using a linear interaction energy (LIE) approach with reliability estimation: application to the D3R Grand Challenge 2.Integrative Modeling Strategies for Predicting Drug Toxicities at the eTOX Project.
P2860
Q28543572-5301EC8E-60F8-4CCC-B444-0A16E89BEE88Q28550779-45E013F3-0DDF-4439-A064-97478FBF7F50Q28649911-C0EFB5F3-7386-4E07-B546-6299D2015516Q38641282-B6DEBDDE-832C-4158-BBCE-C8E085F855DFQ40117005-8FEC1C41-7845-4865-A5E8-CA77D529F4E5Q41902016-EDB4FC7D-382A-4DC9-8837-55D7ECB0E9A4Q47166149-F2399C0D-C5D5-4CCB-B44E-94FFA76B1785Q47827032-F6C983CB-6CAB-4EE4-9C8F-6A44E0559715Q50970812-F463B5BC-E6DB-43C6-8773-ABDD2D1E65D5
P2860
CYP 2D6 binding affinity predictions using multiple ligand and protein conformations.
description
2013 nî lūn-bûn
@nan
2013年の論文
@ja
2013年論文
@yue
2013年論文
@zh-hant
2013年論文
@zh-hk
2013年論文
@zh-mo
2013年論文
@zh-tw
2013年论文
@wuu
2013年论文
@zh
2013年论文
@zh-cn
name
CYP 2D6 binding affinity predictions using multiple ligand and protein conformations.
@en
CYP 2D6 binding affinity predictions using multiple ligand and protein conformations.
@nl
type
label
CYP 2D6 binding affinity predictions using multiple ligand and protein conformations.
@en
CYP 2D6 binding affinity predictions using multiple ligand and protein conformations.
@nl
prefLabel
CYP 2D6 binding affinity predictions using multiple ligand and protein conformations.
@en
CYP 2D6 binding affinity predictions using multiple ligand and protein conformations.
@nl
P2860
P356
P1476
CYP 2D6 binding affinity predictions using multiple ligand and protein conformations.
@en
P2093
Eva Stjernschantz
Lovorka Perić-Hassler
P2860
P304
24514-24530
P356
10.3390/IJMS141224514
P407
P577
2013-12-17T00:00:00Z