1st International EPR-on-a-chip Workshop

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1st International EPR-on-a-chip Workshop

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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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02-29-2020, 09:52 PM

nmrlearner

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1st International EPR-on-a-chip Workshop

From The DNP-NMR Blog:

1st International EPR-on-a-chip Workshop

EPR-on-a-chip is an emerging technology that aims at providing the analytical power of electron paramagnetic resonance (EPR) spectroscopy in the tiny form factor of a millimeter-sized microchip.

Within the BMBF sponsored research project EPRoC, the possibilities of this new and fascinating technology are evaluated in the context of operando EPR measurements on energy materials.

The goal of the 1st International EPR-on-a-chip Workshop is to serve as a forum for discussing the possibilities of the EPR-on-a-chip technology in other disciplines, including catalysis, biology and medicine.

For more information visit: https://www.iis.uni-stuttgart.de/ins...ents/eproc2020

Go to The DNP-NMR Blog for more info.

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