(Q30588639)

25 June 2017

Leap-dynamics: efficient sampling of conformational space of proteins and peptides in solution (English)

1 reference

25 June 2017

Kleinjung J

1

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25 June 2017

Bayley P

series ordinal

2

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25 June 2017

Fraternali F

series ordinal

3

1 reference

25 June 2017

language of work or name

English

0 references

publication date

1 March 2000

1 reference

25 June 2017

6

1 reference

based on heuristic

inferred from page(s)

published in

FEBS Letters

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25 June 2017

470

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25 June 2017

257-262

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25 June 2017

3

1 reference

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

25 June 2017

1 reference

https://api.crossref.org/works/10.1016%2FS0014-5793%2800%2901295-3

A glimpse of the Holy Grail?

21 January 2018

1 reference

https://api.crossref.org/works/10.1016%2FS0014-5793%2800%2901295-3

Problems in simulating macromolecular movements

21 January 2018

1 reference

https://api.crossref.org/works/10.1016%2FS0014-5793%2800%2901295-3

A structure refinement method based on molecular dynamics in four spatial dimensions.

21 January 2018

1 reference

https://api.crossref.org/works/10.1016%2FS0014-5793%2800%2901295-3

Essential dynamics of proteins

21 January 2018

1 reference

https://api.crossref.org/works/10.1016%2FS0014-5793%2800%2901295-3

Protein dynamics simulations from nanoseconds to microseconds

21 January 2018

1 reference

https://api.crossref.org/works/10.1016%2FS0014-5793%2800%2901295-3

Long timestep dynamics of peptides by the dynamics driver approach.

21 January 2018

1 reference

https://api.crossref.org/works/10.1016%2FS0014-5793%2800%2901295-3

Structure of bovine pancreatic trypsin inhibitor. Results of joint neutron and X-ray refinement of crystal form II

21 January 2018

1 reference

https://api.crossref.org/works/10.1016%2FS0014-5793%2800%2901295-3

Influence of internal dynamics on accuracy of protein NMR structures: derivation of realistic model distance data from a long molecular dynamics trajectory.

21 January 2018

1 reference

https://api.crossref.org/works/10.1016%2FS0014-5793%2800%2901295-3

Comparison of MD simulations and NMR experiments for hen lysozyme. Analysis of local fluctuations, cooperative motions, and global changes

21 January 2018

1 reference

https://api.crossref.org/works/10.1016%2FS0014-5793%2800%2901295-3

Computational approaches to study protein unfolding: hen egg white lysozyme as a case study

21 January 2018

1 reference

https://api.crossref.org/works/10.1016%2FS0014-5793%2800%2901295-3

Structure and internal dynamics of the bovine pancreatic trypsin inhibitor in aqueous solution from long-time molecular dynamics simulations.

21 January 2018

1 reference

https://api.crossref.org/works/10.1016%2FS0014-5793%2800%2901295-3

Simultaneous refinement of the structure of BPTI against NMR data measured in solution and X-ray diffraction data measured in single crystals

21 January 2018

1 reference

https://api.crossref.org/works/10.1016%2FS0014-5793%2800%2901295-3

Crystal structure of a Y35G mutant of bovine pancreatic trypsin inhibitor

21 January 2018

1 reference

https://api.crossref.org/works/10.1016%2FS0014-5793%2800%2901295-3

Cryocrystallography of biological macromolecules: a generally applicable method

21 January 2018

1 reference

https://api.crossref.org/works/10.1016%2FS0014-5793%2800%2901295-3

Dictionary of protein secondary structure: pattern recognition of hydrogen-bonded and geometrical features

21 January 2018

1 reference

https://api.crossref.org/works/10.1016%2FS0014-5793%2800%2901295-3

MOLMOL: a program for display and analysis of macromolecular structures

21 January 2018

1 reference

https://api.crossref.org/works/10.1016%2FS0014-5793%2800%2901295-3

WHAT IF: a molecular modeling and drug design program

21 January 2018

1 reference

https://api.crossref.org/works/10.1016%2FS0014-5793%2800%2901295-3

PROCHECK: a program to check the stereochemical quality of protein structures

21 January 2018

1 reference

https://api.crossref.org/works/10.1016%2FS0014-5793%2800%2901295-3

Effective energy function for proteins in solution

21 January 2018

1 reference

https://api.crossref.org/works/10.1016%2FS0014-5793%2800%2901295-3

Comparing short protein substructures by a method based on backbone torsion angles.

21 January 2018

1 reference

https://api.crossref.org/works/10.1016%2FS0014-5793%2800%2901295-3

SWARM-MD: Searching Conformational Space by Cooperative Molecular Dynamics

21 January 2018

1 reference

https://api.crossref.org/works/10.1016%2FS0014-5793%2800%2901295-3

An Efficient Mean Solvation Force Model for Use in Molecular Dynamics Simulations of Proteins in Aqueous Solution

21 January 2018

1 reference

https://api.crossref.org/works/10.1016%2FS0014-5793%2800%2901295-3

Prediction of protein conformational freedom from distance constraints

21 January 2018

1 reference

https://api.crossref.org/works/10.1016%2FS0014-5793%2800%2901295-3

Enhanced protein flexibility caused by a destabilizing amino acid replacement in BPTI

7 January 2021

1 reference

https://api.crossref.org/works/10.1016%2FS0014-5793%2800%2901295-3

Determinants of backbone dynamics in native BPTI: cooperative influence of the 14-38 disulfide and the Tyr35 side-chain

7 January 2021

1 reference

https://api.crossref.org/works/10.1016%2FS0014-5793%2800%2901295-3

10.1016/S0014-5793(00)01295-3

7 January 2021

Identifiers

DOI

1 reference

25 June 2017

1 reference