How does averaging affect protein structure comparison on the ensemble level? (Q30343665)

19 September 2017

How does averaging affect protein structure comparison on the ensemble level? (English)

1 reference

19 September 2017

2

Vijay S Pande

1 reference

19 September 2017

Bojan Zagrovic

1

1 reference

PMC publication ID

1304649

19 September 2017

language of work or name

English

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publication date

1 October 2004

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19 September 2017

7

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inferred from page(s)

published in

Biophysical Journal

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19 September 2017

87

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19 September 2017

4

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19 September 2017

2240-2246

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Folding a protein in a computer: An atomic description of the folding/unfolding of protein A

19 September 2017

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1304649

Analysis of the distributed computing approach applied to the folding of a small beta peptide

3 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1304649

Experimental tests of villin subdomain folding simulations

3 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1304649

Atomistic protein folding simulations on the submillisecond time scale using worldwide distributed computing

3 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1304649

The Trp cage: folding kinetics and unfolded state topology via molecular dynamics simulations

3 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1304649

Absolute comparison of simulated and experimental protein-folding dynamics

3 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1304649

Toward a taxonomy of the denatured state: small angle scattering studies of unfolded proteins

3 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1304649

Simulation of folding of a small alpha-helical protein in atomistic detail using worldwide-distributed computing

3 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1304649

Native-like mean structure in the unfolded ensemble of small proteins

3 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1304649

All-Atom Structure Prediction and Folding Simulations of a Stable Protein

3 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1304649

Protein folding and unfolding at atomic resolution

3 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1304649

From folding theories to folding proteins: a review and assessment of simulation studies of protein folding and unfolding

3 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1304649

Protein folding and unfolding in microseconds to nanoseconds by experiment and simulation

3 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1304649

Folding simulations of a three-stranded antiparallel beta -sheet peptide

3 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1304649

3 June 2018

The Protein Data Bank

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1304649

Pathways to a protein folding intermediate observed in a 1-microsecond simulation in aqueous solution

3 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1304649

NMR structure of the 35-residue villin headpiece subdomain

3 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=1304649

Exploring the energy landscape of a beta hairpin in explicit solvent

3 June 2018

1 reference

12 December 2020

Beta-hairpin folding simulations in atomistic detail using an implicit solvent model

1 reference

12 December 2020

Structural correspondence between the alpha-helix and the random-flight chain resolves how unfolded proteins can have native-like properties

1 reference

12 December 2020

The OPLS [optimized potentials for liquid simulations] potential functions for proteins, energy minimizations for crystals of cyclic peptides and crambin

1 reference

12 December 2020

The Key to Solving the Protein-Folding Problem Lies in an Accurate Description of the Denatured State

1 reference

12 December 2020

10.1529/BIOPHYSJ.104.042184

Identifiers

DOI

1 reference

19 September 2017

1 reference

PMC publication ID

1304649

19 September 2017

PubMed publication ID

15454426

1 reference

PMC publication ID

1304649