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List of works by David M Rogers

A combined resonance enhanced multiphoton ionization and ab initio study of the first absorption band of 1,2,4,5-tetrafluorobenzene, pentafluorobenzene, and hexafluorobenzene

scientific article published on 01 October 2014

Calculations of protein circular dichroism from first principles.

scientific article published in May 2004

Can Dispersion Forces Govern Aromatic Stacking in an Organic Solvent?

scientific article published on 3 December 2015

Coherent ultrafast lattice-directed reaction dynamics of triiodide anion photodissociation.

scientific article

Directly probing spin dynamics in a molecular magnet with femtosecond time-resolution.

scientific article

Femtosecond photodissociation dynamics of 1,4-diiodobenzene by gas-phase X-ray scattering and photoelectron spectroscopy

scientific article published on 19 September 2016

First-principles calculations of protein circular dichroism in the near ultraviolet.

scientific article

Force Fields for Macromolecular Assemblies Containing Diketopyrrolopyrrole and Thiophene

scientific article published on 10 July 2020

Ligand coordination modulates reductive elimination from aluminium(iii).

scientific article published on 17 August 2016

Modeling the Absorption Spectrum of Tryptophan in Proteins

scientific article published in December 2005

Preorganized tridentate analogues of mixed hydroxyoxime/carboxylate nickel extractants.

scientific article

Quantifying signal changes in nano-wire based biosensors

scientific article published on 20 December 2010

Salicylaldehyde Hydrazones: Buttressing of Outer-Sphere Hydrogen-Bonding and Copper Extraction Properties

Ultrafast photodissociation dynamics of 1,4-diiodobenzene

Very fast prediction and rationalization of pKa values for protein-ligand complexes

scientific article

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