Long-term effectiveness of the alcohol ignition interlock programme: A retrospective cohort study in the Netherlands.

This article provides an evaluation of the long-term effectiveness of the Alcohol Ignition Interlock Programme (AIIP) on recidivism. A retrospective cohort design was used to compare the known reoffending behaviour of 1676 AIIP participants with that of 907 persons in a control group, consisting of offenders who committed an AIIP-worthy driving-under-the-influence (DUI) offence that was not reported to the Dutch driving license authority. Persons in the control group were not sanctioned with an AIIP, but had their case settled in the criminal court. Our outcome measure was the percentage of offenders who committed at least one new DUI offence within the follow-up period. Results indicate that the percentage of repeat offenders in the AIIP group was lower than in the control group. Additional analyses indicate that were an AIIP to be imposed alongside a criminal settlement, a recidivism reduction of 4 percentage points (4 % versus 8 %) could be expected. This would translate to a relative decrease of 54 %. Explanations for these findings are discussed.

Differentiating Individuals Convicted of Sexual Offenses: A Two-Country Latent Class Analysis.

Sexual offenses are often part of a larger criminal career also encompassing nonsexual crimes. However, most sexual offending typologies focus on an individual's most recent sexual offense. We compare data from Belgian and Dutch national conviction cohorts and use latent class analysis to distinguish groups of individuals based on their history of sexual and nonsexual offenses, considering continuity and variety. The resulting classification is compared between individuals convicted of sexual offenses and individuals convicted of nonsexual offenses. Results show that four latent classes can be distinguished based on continuity and variety in criminal histories of individuals convicted of sexual offenses, and that some of these classes resemble those distinguished among individuals convicted of nonsexual offenses. We find limited overlap between these latent classes and typologies based solely on the index offense. Results show marked similarities across countries. These results challenge theories of sexual offending to incorporate patterns of nonsexual offending.

Conformations and vibrational spectra of a model tripeptide: change of secondary structure upon micro-solvation.

Mid-infrared (IR) hole burning spectra of the model tripeptide Z-Aib-Pro-NHMe (Z = benzyloxycarbonyl) in gas phase and its micro-clusters with one and two methanol molecules are presented. To establish a relation between experimental spectra and the underlying conformations, calculations at the DFT [B3LYP/6-311++G(d,p)] level of theory are performed. In particular, the intra-peptide and the peptide-methanol hydrogen bonds can be identified from spectral shifts in the amide I, II, and III regions. While the unsolvated tripeptide as well as its one-methanol cluster prefer a gamma-turn structure, a beta-turn structure is found for the two-methanol cluster, in agreement with previous condensed phase studies. Comparison of measured and simulated spectra reveals that the favorable methanol binding sites are at the head and tail parts of the tripeptide. The interconversions between gamma-turn and beta-turn structures are governed by potential barriers below 10 kJ mol(-1) inside one of the low energy basins of the potential energy surface.

Stepwise solvation of an amino acid: the appearance of zwitterionic structures.

How many solvent molecules are required to solvate an amino acid? This apparently simple question, which relates to the number of solvent molecules necessary to change the amino acid from its gas-phase neutral structure to the zwitterionic solvated structure, remains unanswered to date. Here we present experimental and theoretical (density functional theory: B3LYP/6-31+G**) infrared spectra for tryptophan-watern complexes where n = 1-6, which suggest that the zwitterionic structure becomes competitive in energy at the high end of the series. Compelling evidence for a gradual transition to zwitterionic structures comes from tryptophan-methanol complexes up to n = 9. Starting from n = 5, the infrared spectra show increasing intensity in the diagnostic asymmetric COO- stretch and in the weaker NH3+ bending modes as the cluster size increases. Moreover, convergence toward the Fourier transform infrared spectrum of a solution of tryptophan in methanol is clearly observed. For small solvent complexes (n = 1-4), the microsolvation by methanol and water is shown to behave very similarly. A detailed comparison of the experimental and the theoretical spectra allows us to determine both the preferred solvent binding sites on the amino acid and the evolution of conformational structures of tryptophan as the number of attached solvent molecules increases.

Experimental structure determination of silver cluster ions (Ag(n) +, 19 < or = n < or = 79).

The structures of mass selected silver cluster cations Ag19 +, Ag38 +, Ag55 +, Ag59 +, Ag75 +, and Ag79 + have been probed at a temperature of 100 K by trapped ion electron diffraction. The structure assignment is carried out by comparison of the experimental scattering intensity with theoretical scattering functions of calculated candidate structures obtained by density functional theory. For the cluster sizes studied the resulting experimental data are invariably best described by structures based on the icosahedral motif, while closed packed structures can be ruled out.

The structures of Ag55+ and Ag55- : trapped ion electron diffraction and density functional theory.

We report the experimental structure determination of cold, mass selected Ag(55)(+/-) cluster ions using the recently developed technique of trapped ion electron diffraction. By comparison of experimental and theoretical molecular scattering functions and consideration of computed total energies, we show that Ag(55)(+) constitutes an ideal Mackay icosahedron, whereas Ag(55)(-) is a weakly Jahn-Teller distorted icosahedron. Isomers of other structural types, for example, decahedral or close-packed, could be ruled out. The candidate structures were obtained by density functional theory calculations.