Principles of docking: An overview of search algorithms and a guide to scoring functions
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Interactomic and pharmacological insights on human sirt-1Improved side-chain modeling for protein-protein dockingInteractions of human melanocortin 4 receptor with nonpeptide and peptide agonistsPredicting absolute ligand binding free energies to a simple model siteInteraction profile-based protein classification of death domainRefinement of docked protein-ligand and protein-DNA structures using low frequency normal mode amplitude optimization.Molecular flexibility in ab initio drug docking to DNA: binding-site and binding-mode transitions in all-atom Monte Carlo simulationsMEDock: a web server for efficient prediction of ligand binding sites based on a novel optimization algorithmBioinformatics in microbial biotechnology--a mini review.Insights into Protein-Ligand Interactions: Mechanisms, Models, and MethodsStructural and Computational Biology in the Design of Immunogenic Vaccine AntigensVisualizing functional motions of membrane transporters with molecular dynamics simulationsComputational studies of marine toxins targeting ion channelsComputational methods in drug discoveryStructure, dynamics, and interaction of Mycobacterium tuberculosis (Mtb) DprE1 and DprE2 examined by molecular modeling, simulation, and electrostatic studiesATTRACT-EM: a new method for the computational assembly of large molecular machines using cryo-EM mapsApplication of the PM6 semi-empirical method to modeling proteins enhances docking accuracy of AutoDockVirtual Screening Approaches towards the Discovery of Toll-Like Receptor ModulatorsApplication of consensus scoring and principal component analysis for virtual screening against β-secretase (BACE-1)Phytol/Phytanic acid and insulin resistance: potential role of phytanic acid proven by docking simulation and modulation of biochemical alterationsProtein-protein docking with F(2)Dock 2.0 and GB-rerankOptimal ligand descriptor for pocket recognition based on the Beta-shapeLigand Docking to Intermediate and Close-To-Bound Conformers Generated by an Elastic Network Model Based Algorithm for Highly Flexible ProteinsAchievements and challenges in structural bioinformatics and computational biophysicsDockRank: Ranking docked conformations using partner-specific sequence homology-based protein interface predictionAutoDock4 and AutoDockTools4: Automated docking with selective receptor flexibilityStructural modeling of protein interactions by analogy: application to PSD-95The role of geometric complementarity in secondary structure packing: a systematic docking study.Selectivity and specificity of substrate binding in methionyl-tRNA synthetase.NONUNIFORM FOURIER TRANSFORMS FOR RIGID-BODY AND MULTI-DIMENSIONAL ROTATIONAL CORRELATIONS.Bringing Clarity to the Prediction of Protein-Ligand Binding Free Energies via "Blurring"Heterogeneous preferential solvation of water and trifluoroethanol in homologous lysozymes.Accurate Prediction of Docked Protein Structure Similarity.Docking screens: right for the right reasons?Comparing pharmacophore models derived from crystal structures and from molecular dynamics simulationsComputational methods in drug discovery.Accelerating large-scale protein structure alignments with graphics processing units.LIGSITEcsc: predicting ligand binding sites using the Connolly surface and degree of conservationThe hydrophobic temperature dependence of amino acids directly calculated from protein structuresKinetics and thermodynamics of type VIII beta-turn formation: a CD, NMR, and microsecond explicit molecular dynamics study of the GDNP tetrapeptide.
P2860
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P2860
Principles of docking: An overview of search algorithms and a guide to scoring functions
description
2002 nî lūn-bûn
@nan
2002 թուականի Յունիսին հրատարակուած գիտական յօդուած
@hyw
2002 թվականի հունիսին հրատարակված գիտական հոդված
@hy
2002年の論文
@ja
2002年論文
@yue
2002年論文
@zh-hant
2002年論文
@zh-hk
2002年論文
@zh-mo
2002年論文
@zh-tw
2002年论文
@wuu
name
Principles of docking: An overview of search algorithms and a guide to scoring functions
@ast
Principles of docking: An overview of search algorithms and a guide to scoring functions
@en
Principles of docking: An overview of search algorithms and a guide to scoring functions
@nl
type
label
Principles of docking: An overview of search algorithms and a guide to scoring functions
@ast
Principles of docking: An overview of search algorithms and a guide to scoring functions
@en
Principles of docking: An overview of search algorithms and a guide to scoring functions
@nl
prefLabel
Principles of docking: An overview of search algorithms and a guide to scoring functions
@ast
Principles of docking: An overview of search algorithms and a guide to scoring functions
@en
Principles of docking: An overview of search algorithms and a guide to scoring functions
@nl
P2093
P3181
P356
P1433
P1476
Principles of docking: An overview of search algorithms and a guide to scoring functions
@en
P2093
Haim Wolfson
Inbal Halperin
P304
P3181
P356
10.1002/PROT.10115.ABS
P407
P577
2002-06-01T00:00:00Z