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LIBSA – A Method for the Determination of Ligand-Binding Preference to Allosteric Sites on Receptor Ensembles

https://doi.org/10.1021/ci400474u
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What this work says

Outgoing claims: the papers this work cites, builds on, or argues with.

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What points at this work

Incoming claims: where this work appears in other papers’ reference lists and arguments.

inferred← citeshttps://doi.org/10.1002/prot.24786openalex-snapshot
Binding hotspots on K-ras: Consensus ligand binding sites and other reactive regions from probe-based molecular dynamics analysis
inferred← citeshttps://doi.org/10.1007/978-1-0716-0270-6_8openalex-snapshot
Systematic Exploration of Binding Modes of Ligands on Drug Targets
inferred← citeshttps://doi.org/10.1016/b978-0-12-409547-2.12324-8openalex-snapshot
Allosteric Modulators
inferred← citeshttps://doi.org/10.1021/acs.jctc.7b00130openalex-snapshot
Mixed-Probe Simulation and Probe-Derived Surface Topography Map Analysis for Ligand Binding Site Identification
inferred← citeshttps://doi.org/10.1021/acsomega.3c04013openalex-snapshot
Small-Molecule Inhibition of KRAS through Conformational Selection
inferred← citeshttps://doi.org/10.1080/07391102.2021.1935320openalex-snapshot
Electronic and structural study of T315I mutated form in DFG-out conformation of BCR-ABL inhibitors
inferred← citeshttps://doi.org/10.1080/21541248.2019.1655883openalex-snapshot
Approaches to inhibiting oncogenic K-Ras
inferred← citeshttps://doi.org/10.1093/abbs/gmv100openalex-snapshot
Computational allosteric ligand binding site identification on Ras proteins
inferred← citeshttps://doi.org/10.1111/cbdd.13519openalex-snapshot
Multi‐target, ensemble‐based virtual screening yields novel allosteric KRAS inhibitors at high success rate
inferred← citeshttps://doi.org/10.1186/s12859-022-04995-2openalex-snapshot
A multilayer dynamic perturbation analysis method for predicting ligand–protein interactions
inferred← citeshttps://doi.org/10.1186/s13321-017-0255-6openalex-snapshot
Systematic exploration of multiple drug binding sites
inferred← citeshttps://doi.org/10.1208/s12248-015-9776-yopenalex-snapshot
Computational Advances for the Development of Allosteric Modulators and Bitopic Ligands in G Protein-Coupled Receptors
inferred← citeshttps://doi.org/10.1371/journal.pcbi.1003872openalex-snapshot
Evidence of Conformational Selection Driving the Formation of Ligand Binding Sites in Protein-Protein Interfaces
inferred← citeshttps://doi.org/10.1371/journal.pone.0198632openalex-snapshot
Allosteric binding sites in Rab11 for potential drug candidates
inferred← citeshttps://doi.org/10.15476/elte.2018.091openalex-snapshot
Systematic exploration of multiple drug binding sites
inferred← citeshttps://doi.org/10.6084/m9.figshare.21485795openalex-snapshot
Additional file 1 of A multilayer dynamic perturbation analysis method for predicting ligand–protein interactions
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