Cavities on the Surfaces of Macromolecules (original) (raw)

Characterizing the morphology of protein binding patches

Frederic Cazals

Proteins: Structure, Function, and Bioinformatics, 2012

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A fast surface-matching procedure for protein–ligand docking

Bernard Maigret

Journal of molecular …, 2006

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A geometric approach to molecular docking and similarity

Chandrajit Bajaj

1994

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Dictionary of interfaces in proteins (DIP). Data bank of complementary molecular surface patches

Robert Preissner, Andrean Goede

Journal of Molecular Biology, 1998

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Shape complementarity at protein-protein interfaces

Raquel Norel

Biopolymers, 1994

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Molecular Surface Complementarity at Protein-Protein Interfaces: The Critical Role Played by Surface Normals at Well Placed, Sparse, Points in Docking

Raquel Norel

Journal of Molecular Biology, 1995

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Surface-histogram: A new shape descriptor for protein-protein docking

Patrice Koehl

Proteins: Structure, Function, and Bioinformatics, 2012

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Characterisation of Protein-Ligand Interfaces: Separating Surfaces

Jürgen Brickmann

Journal of Molecular Modeling, 1998

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Characterizing the Morphology . . . Binding Patches

Achin Bansal

2011

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Geometric Detection Algorithms for Cavities on Protein Surfaces in Molecular Graphics: A Survey

Abel Gomes

Computer Graphics Forum

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Geometric analysis and comparison of protein-DNA interfaces: why is there no simple code for recognition?

lena nekludova

Journal of Molecular Biology, 2000

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Computational Mapping of Anchoring Spots on Protein Surfaces

Miriam Eisenstein

Journal of Molecular Biology, 2010

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Protein docking algorithms: simulating molecular recognition

Joel Janin

Current Opinion in Structural Biology, 1993

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Visual Analysis of Biomolecular Surfaces

Bernd Hamann

Mathematics and Visualization, 2008

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Template-based protein–protein docking exploiting pairwise interfacial residue restraints

Vasant G Honavar

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Triangulation of molecular surfaces

Joonghyun Ryu

Computer-aided Design, 2009

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Docking by structural similarity at protein-protein interfaces

rohita sinha

2008

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On proteins, grids, correlations, and docking

Miriam Eisenstein

Comptes Rendus Biologies, 2004

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Visualization of Solution Sets from Automated Docking of Molecular Structures

Michelle Kuttel

2010

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Surface motifs by a computer vision technique: Searches, detection, and implications for protein-ligand recognition

Haim Wolfson

Proteins: Structure, Function, and Genetics, 1993

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Intersurf: dynamic interface between proteins

Jean-claude Paul, Bernard Maigret

Journal of Molecular Graphics and Modelling, 2005

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Generative Topographic Mapping of the Docking Conformational Space

Dragos Horvath

Molecules, 2019

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Defining and characterizing protein surface using alpha shapes

dino moras

Proteins: Structure, Function, and Bioinformatics, 2009

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Protein Molecular Surface Mapped at Different Geometrical Resolutions

Dan Nicolau

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Sampling geometries of protein-protein complexes

Stephan Lorenzen

Genome informatics. International Conference on Genome Informatics, 2008

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Protein Docking by the Interface Structure Similarity: How Much Structure Is Needed?

rohita sinha

2011

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Accurate Detection of Protein:Ligand Binding Sites Using Molecular Dynamics Simulations

Akshay Bhinge

Structure, 2004

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Structure-based method for analyzing protein–protein interfaces

Ying Gao

Journal of Molecular Modeling, 2004

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Computational analyses of the surface properties of protein–protein interfaces

Rhodri Saunders

Acta Crystallographica Section D Biological Crystallography, 2007

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Fourier-filtered van der Waals contact surfaces: accurate ligand shapes from protein structures

Jonathan Friedman

Protein Engineering Design and Selection, 1997

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