Cluster or periodic, static or dynamic—the challenge of calculating the g tensor of the solid-state glycine radical

Radiation damage in macromolecular crystallography: what is it and why should we care?

(2010) Elspeth F. Garman   ACTA CRYSTALLOGRAPHICA SECTION D-BIOLOGICAL CRYSTALLOGRAPHY

One-Electron Oxidation of Individual DNA Bases and DNA Base Stacks

(2010) David M. Close   JOURNAL OF PHYSICAL CHEMISTRY A

Free Radicals inl-Arginine·HCl·H2O Single Crystals X-irradiated at 66K- EPR, ENDOR, EIE and DFT Studies

(2010) Yiying Zhou et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Radicals in 5-Methylcytosine Induced by Ionizing Radiation. Electron Magnetic Resonance for Structural and Mechanistic Analyses

(2010) André Krivokapić et al.   RADIATION RESEARCH

Magnetic linear response properties calculations with the Gaussian and augmented-plane-wave method

(2009) Valéry Weber et al.   JOURNAL OF CHEMICAL PHYSICS

Comparative Theoretical and Experimental Study of the Radiation-Induced Decomposition of Glycine

(2009) R. G. Wilks et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Mechanisms of Strand Break Formation in DNA due to the Direct Effect of Ionizing Radiation: The Dependency of Free Base Release on the Length of Alternating CG Oligodeoxynucleotides

(2009) Kiran K. Sharma et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Oxidation and Reduction Products of X Irradiation at 10 K in Sucrose Single Crystals: Radical Identification by EPR, ENDOR, and DFT

(2009) Hendrik De Cooman et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Proton-Coupled Hole Transfer in X-irradiated Doped Crystalline Cytosine·H2O

(2008) André Krivokapić et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Radiation-Induced Radicals in Glucose-1-phosphate. I. Electron Paramagnetic Resonance and Electron Nuclear Double Resonance Analysis ofin situX-Irradiated Single Crystals at 77 K

(2008) Hendrik De Cooman et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Temperature Study of a Glycine Radical in the Solid State Adopting a DFT Periodic Approach: Vibrational Analysis and Comparison with EPR Experiments

(2008) Ewald Pauwels et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Radiation-Induced Radicals in Glucose-1-phosphate. II. DFT Analysis of Structures and Possible Formation Mechanisms

(2008) Ewald Pauwels et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Structure and ESR features of a radiation-induced radical in α-glycine crystals

(2007) Vincenzo Barone et al.   CHEMICAL PHYSICS LETTERS

Effect of temperature on the EPR properties of a rhamnose alkoxy radical: A DFT molecular dynamics study

(2007) Ewald Pauwels et al.   SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY