(Q30385001)

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:20111782%20AND%20SRC:MED&resulttype=core&format=json

17 January 2020

review article

1 reference

title

NMR chemical shift data and ab initio shielding calculations: emerging tools for protein structure determination (English)

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:20111782%20AND%20SRC:MED&resulttype=core&format=json

protein structure determination

17 January 2020

main subject

chemical shift

0 references

0 references

author

Frans A.A. Mulder

series ordinal

1

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:20111782%20AND%20SRC:MED&resulttype=core&format=json

17 January 2020

author name string

Michael Filatov

series ordinal

2

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:20111782%20AND%20SRC:MED&resulttype=core&format=json

17 January 2020

publication date

4 November 2009

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:20111782%20AND%20SRC:MED&resulttype=core&format=json

17 January 2020

published in

Chemical Society Reviews

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:20111782%20AND%20SRC:MED&resulttype=core&format=json

17 January 2020

volume

39

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:20111782%20AND%20SRC:MED&resulttype=core&format=json

17 January 2020

issue

2

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:20111782%20AND%20SRC:MED&resulttype=core&format=json

17 January 2020

page(s)

578-590

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:20111782%20AND%20SRC:MED&resulttype=core&format=json

1H, 13C and 15N random coil NMR chemical shifts of the common amino acids. I. Investigations of nearest-neighbor effects

17 January 2020

cites work

1 reference

Sequence-dependent correction of random coil NMR chemical shifts

21 January 2018

1 reference

Protein backbone chemical shifts predicted from searching a database for torsion angle and sequence homology

21 January 2018

1 reference

Probability-based protein secondary structure identification using combined NMR chemical-shift data

21 January 2018

1 reference

Dependence of amino acid side chain 13C shifts on dihedral angle: application to conformational analysis

21 January 2018

1 reference

Leucine side-chain conformation and dynamics in proteins from 13C NMR chemical shifts.

21 January 2018

1 reference

The 13C chemical-shift index: a simple method for the identification of protein secondary structure using 13C chemical-shift data

21 January 2018

1 reference

Rapid and accurate calculation of protein 1H, 13C and 15N chemical shifts

21 January 2018

1 reference

Protein backbone angle restraints from searching a database for chemical shift and sequence homology

21 January 2018

1 reference

Consistent blind protein structure generation from NMR chemical shift data

21 January 2018

1 reference

Protein structure determination from NMR chemical shifts

21 January 2018

1 reference

Protein NMR chemical shift calculations based on the automated fragmentation QM/MM approach.

21 January 2018

1 reference

Perturbed Hartree—Fock Calculations. I. Magnetic Susceptibility and Shielding in the LiH Molecule

21 January 2018

1 reference

Chemical shifts in amino acids, peptides, and proteins: from quantum chemistry to drug design

21 January 2018

1 reference

Determination of the relative stereochemistry of flexible organic compounds by Ab initio methods: conformational analysis and Boltzmann-averaged GIAO 13C NMR chemical shifts.

21 January 2018

1 reference

A solid state 13C NMR, crystallographic, and quantum chemical investigation of chemical shifts and hydrogen bonding in histidine dipeptides

21 January 2018

1 reference

A solid state 13C NMR, crystallographic, and quantum chemical investigation of phenylalanine and tyrosine residues in dipeptides and proteins.

21 January 2018

1 reference

Carbon-13 NMR shielding in the twenty common amino acids: comparisons with experimental results in proteins

21 January 2018

1 reference

A comparison of quantum chemical models for calculating NMR shielding parameters in peptides: mixed basis set and ONIOM methods combined with a complete basis set extrapolation

21 January 2018

1 reference

Tryptophan chemical shift in peptides and proteins: a solid state carbon-13 nuclear magnetic resonance spectroscopic and quantum chemical investigation

21 January 2018

1 reference

Protein NMR spectroscopy in structural genomics

21 January 2018

1 reference

Polarizabilities in the condensed phase and the local fields problem: A direct reaction field formulation

21 January 2018

1 reference

Are current molecular dynamics force fields too helical?

21 January 2018

1 reference

Site-Specific Variations of Carbonyl Chemical Shift Anisotropies in Proteins

21 January 2018

1 reference