(Q40867870)

24 September 2017

Comparison of protein surfaces using a genetic algorithm (English)

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24 September 2017

Poirrette AR

1

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24 September 2017

Artymiuk PJ

series ordinal

2

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24 September 2017

Rice DW

series ordinal

3

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24 September 2017

Willett P

series ordinal

4

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24 September 2017

1 November 1997

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Journal of Computer - Aided Molecular Design

24 September 2017

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24 September 2017

11

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24 September 2017

6

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24 September 2017

557-569

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https://scigraph.springernature.com/pub.10.1023/a:1007966011516

24 September 2017

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Protein clefts in molecular recognition and function

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12 December 2020

Molecular surface-volume and property matching to superpose flexible dissimilar molecules.

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12 December 2020

Structure of myoglobin refined at 2-0 A resolution. II. Structure of deoxymyoglobin from sperm whale

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Crystallographic refinement of the three-dimensional structure of the FabD1.3-lysozyme complex at 2.5-A resolution

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12 December 2020

Identification of tertiary structure resemblance in proteins using a maximal common subgraph isomorphism algorithm.

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12 December 2020

X-ray crystal structure of the complex of human leukocyte elastase (PMN elastase) and the third domain of the turkey ovomucoid inhibitor

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12 December 2020

Three-dimensional structure of influenza A N9 neuraminidase and its complex with the inhibitor 2-deoxy 2,3-dehydro-N-acetyl neuraminic acid

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12 December 2020

Molecular skins: a new concept for quantitative shape matching of a protein with its small molecule mimics

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12 December 2020

A new tool for the qualitative and quantitative analysis of protein surfaces using B-spline and density of surface neighborhood.

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12 December 2020

Solvent-accessible surfaces of proteins and nucleic acids

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12 December 2020

Molecular recognition of receptor sites using a genetic algorithm with a description of desolvation

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12 December 2020

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

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12 December 2020

Fractal surfaces of proteins.

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12 December 2020

A genetic algorithm for flexible molecular overlay and pharmacophore elucidation.

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12 December 2020

The automatic search for ligand binding sites in proteins of known three-dimensional structure using only geometric criteria.

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12 December 2020

Molecular docking programs successfully predict the binding of a beta-lactamase inhibitory protein to TEM-1 beta-lactamase

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12 December 2020

Techniques for the calculation of three-dimensional structural similarity using inter-atomic distances

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12 December 2020

Protein structure comparisons using a combination of a genetic algorithm, dynamic programming and least-squares minimization

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12 December 2020

Improved genetic algorithm-based protein structure comparisons: pairwise and multiple superpositions

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12 December 2020

Areas, volumes, packing and protein structure

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12 December 2020

The crystal structure of human deoxyhaemoglobin at 1.74 A resolution

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12 December 2020

A fast new approach to pharmacophore mapping and its application to dopaminergic and benzodiazepine agonists.

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12 December 2020

Design and synthesis of new enzymes based on the lactate dehydrogenase framework

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12 December 2020

The Protein Data Bank: a computer-based archival file for macromolecular structures

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12 December 2020

Crystal structures of Escherichia coli dihydrofolate reductase: the NADP+ holoenzyme and the folate.NADP+ ternary complex. Substrate binding and a model for the transition state

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12 December 2020

Use of techniques derived from graph theory to compare secondary structure motifs in proteins

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12 December 2020

Molecular surface representations by sparse critical points

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12 December 2020

The three-dimensional structure of the aspartyl protease from the HIV-1 isolate BRU

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12 December 2020

The structures of Salmonella typhimurium LT2 neuraminidase and its complexes with three inhibitors at high resolution

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12 December 2020

Detection of common three-dimensional substructures in proteins

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12 December 2020

Crystal structure of hen egg-white lysozyme at a hydrostatic pressure of 1000 atmospheres

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12 December 2020

Finding and filling protein cavities using cellular logic operations

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12 December 2020

Hausdorff dimension as a quantification of local roughness of protein surfaces

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12 December 2020

A new approach to analysis and display of local lipophilicity/hydrophilicity mapped on molecular surfaces

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12 December 2020

"Soft docking": matching of molecular surface cubes

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12 December 2020

Genetic algorithms for protein folding simulations.

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12 December 2020

Potential of genetic algorithms in protein folding and protein engineering simulations

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12 December 2020

Crystal structures of Escherichia coli and Lactobacillus casei dihydrofolate reductase refined at 1.7 A resolution. I. General features and binding of methotrexate

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12 December 2020

Identifiers

DOI

10.1023/A:1007966011516

1 reference

journals/jcamd/PoirretteARW97

24 September 2017

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DBLP Dataset 2021-01-02

Dimensions Publication ID

28 January 2021

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