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[NMR900 blog] NMR papers in Nature

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NMR processing:

MDD

NMR assignment:

Backbone:

Side-chains:

NOEs:

Structure from NMR restraints:

Ab initio:

Fragment-based:

Rosetta-NMR (Robetta)

Template-based:

GeNMR

I-TASSER

Refinement:

Amber

Structure from chemical shifts:

Fragment-based:

Homology-based:

Torsion angles from chemical shifts:

Preditor

TALOS

Promega- Proline

Secondary structure from chemical shifts:

CSI (via RCI server)

TALOS

MICS caps, β-turns

d2D

PECAN

Flexibility from chemical shifts:

RCI

Interactions from chemical shifts:

HADDOCK

Chemical shifts re-referencing:

NMR model quality:

NOEs, other restraints:

Chemical shifts:

RDCs:

Pseudocontact shifts:

Protein geomtery:

SAVES2 or SAVES4

Quality Control Check

NMR spectrum prediction:

FANDAS

MestReS

V-NMR

Flexibility from structure:

Backbone S2

Methyl S2

B-factor

Molecular dynamics:

Gromacs

Amber

Antechamber

Chemical shifts prediction:

From structure:

Shiftx2

Sparta+

Camshift

CH3shift- Methyl

ArShift- Aromatic

ShiftS

Proshift

PPM

CheShift-2- Cα

From sequence:

Shifty

Camcoil

Poulsen_rc_CS

Disordered proteins:

MAXOCC

Format conversion & validation:

CCPN

From NMR-STAR 3.1

Validate NMR-STAR 3.1

NMR sample preparation:

Protein disorder:

DisMeta

Protein solubility:

Isotope labeling:

Solid-state NMR:

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08-22-2010, 02:18 AM

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NMR papers in Nature

NMR papers in Nature

M.J. Plevin, D.L. Bryce, and J. Boisbouvier, "Direct Detection of CH/pi Interactions in Proteins," Nature Chemistry (2010) in press. http://dx.doi.org/10.1038/nchem.650

J. Chan, A.R. Lewis, M. Gilbert, M.-F. Karwaski, A.J. Bennet, "A direct NMR method for the measurement of competitive kinetic isotope effects," Nature Chemical Biology (2010) online. http://dx.doi.org/10.1038/nchembio.352

T.D. Ladd, F. Jelezko, R. Laflamme, Y. Nakamura, C. Monroe and J.L. O’Brien, "Quantum computers," Nature 464 (2010) 45-53. (Review) http://dx.doi.org/10.1038/nature08812

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