(Q36831940)

16 August 2017

title

The new program OPAL for molecular dynamics simulations and energy refinements of biological macromolecules (English)

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16 August 2017

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4

Wüthrich K

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16 August 2017

3

Billeter M

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16 August 2017

Luginbühl P

1

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16 August 2017

Güntert P

series ordinal

2

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16 August 2017

publication date

1 September 1996

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Journal of Biomolecular NMR

16 August 2017

published in

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16 August 2017

volume

8

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16 August 2017

issue

2

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16 August 2017

page(s)

136-146

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Hydration of proteins. A comparison of experimental residence times of water molecules solvating the bovine pancreatic trypsin inhibitor with theoretical model calculations

16 August 2017

cites work

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https://pubmed.ncbi.nlm.nih.gov/8914272

12 December 2020

Molecular dynamics studies of a DNA‐binding protein: 1. A comparison of the trp repressor and trp aporepressor aqueous simulations

1 reference

https://pubmed.ncbi.nlm.nih.gov/8914272

12 December 2020

Pseudo-structures for the 20 common amino acids for use in studies of protein conformations by measurements of intramolecular proton-proton distance constraints with nuclear magnetic resonance

1 reference

https://pubmed.ncbi.nlm.nih.gov/8914272

12 December 2020

The program XEASY for computer-supported NMR spectral analysis of biological macromolecules

1 reference

https://pubmed.ncbi.nlm.nih.gov/8914272

12 December 2020

Molecular dynamics studies of a DNA‐binding protein: 2. An evaluation of implicit and explicit solvent models for the molecular dynamics simulation of the Escherichia coli trp repressor

1 reference

https://pubmed.ncbi.nlm.nih.gov/8914272

12 December 2020

NMR - this other method for protein and nucleic acid structure determination.

1 reference

https://pubmed.ncbi.nlm.nih.gov/8914272

12 December 2020

Efficient computation of three-dimensional protein structures in solution from nuclear magnetic resonance data using the program DIANA and the supporting programs CALIBA, HABAS and GLOMSA

1 reference

https://pubmed.ncbi.nlm.nih.gov/8914272

12 December 2020

MOLMOL: a program for display and analysis of macromolecular structures

1 reference

https://pubmed.ncbi.nlm.nih.gov/8914272

12 December 2020

Time-averaged nuclear Overhauser effect distance restraints applied to tendamistat

1 reference

https://pubmed.ncbi.nlm.nih.gov/8914272

12 December 2020

Determination of three-dimensional structures of proteins from interproton distance data by hybrid distance geometry-dynamical simulated annealing calculations

1 reference

https://pubmed.ncbi.nlm.nih.gov/8914272

12 December 2020

Structure refinement using time-averaged J-coupling constant restraints.

1 reference

https://pubmed.ncbi.nlm.nih.gov/8914272

12 December 2020

Accurate simulation of protein dynamics in solution

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https://pubmed.ncbi.nlm.nih.gov/8914272

12 December 2020

The nuclear magnetic resonance solution structure of the mixed disulfide between Escherichia coli glutaredoxin(C14S) and glutathione.

1 reference

https://pubmed.ncbi.nlm.nih.gov/8914272

12 December 2020

The effects of truncating long-range forces on protein dynamics.

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https://pubmed.ncbi.nlm.nih.gov/8914272

12 December 2020

Solvent accessible surface area and excluded volume in proteins. Analytical equations for overlapping spheres and implications for the hydrophobic effect

1 reference

https://pubmed.ncbi.nlm.nih.gov/8914272

12 December 2020

Gene duplications in the structural evolution of chymotrypsin

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https://pubmed.ncbi.nlm.nih.gov/8914272

12 December 2020

Hydration and DNA recognition by homeodomains

1 reference

https://pubmed.ncbi.nlm.nih.gov/8914272

12 December 2020

Three-dimensional structure of the neurotoxin ATX Ia from Anemonia sulcata in aqueous solution determined by nuclear magnetic resonance spectroscopy

1 reference

https://pubmed.ncbi.nlm.nih.gov/8914272

12 December 2020

Computational challenges for macromolecular structure determination by X-ray crystallography and solution NMR-spectroscopy

1 reference

https://pubmed.ncbi.nlm.nih.gov/8914272

12 December 2020

The NMR solution structure of the pheromone Er-2 from the ciliated protozoan Euplotes raikovi

1 reference

https://pubmed.ncbi.nlm.nih.gov/8914272

12 December 2020

Comparison of protein structures determined by NMR in solution and by X-ray diffraction in single crystals

1 reference

https://pubmed.ncbi.nlm.nih.gov/8914272

12 December 2020

Determination of the three-dimensional structure of the Antennapedia homeodomain from Drosophila in solution by 1H nuclear magnetic resonance spectroscopy

1 reference

https://pubmed.ncbi.nlm.nih.gov/8914272

12 December 2020

Identifiers

DOI

10.1007/BF00211160

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16 August 2017

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