Towards automated binding affinity prediction using an iterative linear interaction energy approach.
about
Linear 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 InhibitorsPL-PatchSurfer2: Improved Local Surface Matching-Based Virtual Screening Method That Is Tolerant to Target and Ligand Structure Variation.Improving the iterative Linear Interaction Energy approach using automated recognition of configurational transitions.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
Q28550779-E1E60565-A178-405D-9A18-7A0AE0356296Q28649911-3FF4E711-ACF1-440F-A7AD-6A81D23E83F1Q38641282-80AB9B0D-8A0B-42A0-A324-101F9C5C47B7Q39513411-03FB0816-DB6D-4B2D-93BE-0C294F8C3F56Q40117005-0464343D-2A8E-425D-9D3D-3BB64CB7395AQ47166149-F730BCC8-FCD8-4DA2-BFB1-582BC7813499Q47827032-3B807D50-1D29-4D6D-BD15-DA4F85F2D951Q50970812-24B8599C-000A-492A-BD3C-545E307B15A1
P2860
Towards automated binding affinity prediction using an iterative linear interaction energy approach.
description
2014 nî lūn-bûn
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2014年の論文
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2014年論文
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2014年論文
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2014年論文
@zh-hk
2014年論文
@zh-mo
2014年論文
@zh-tw
2014年论文
@wuu
2014年论文
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2014年论文
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name
Towards automated binding affi ...... r interaction energy approach.
@en
type
label
Towards automated binding affi ...... r interaction energy approach.
@en
prefLabel
Towards automated binding affi ...... r interaction energy approach.
@en
P2093
P2860
P50
P356
P1476
Towards automated binding affi ...... r interaction energy approach.
@en
P2093
C Ruben Vosmeer
Lovorka Peric-Hassler
Mariël F Van Stee
P2860
P304
P356
10.3390/IJMS15010798
P407
P577
2014-01-09T00:00:00Z