We show that conformational entropies calculated for five proteins and protein-ligand complexes with dihedral-distribution histogramming, the von Mises approach, or quasi-harmonic analysis do not converge to any useful precision even if molecular dynamics (MD) simulations of 380-500 ns length are employed (the uncertainty is 12-89 kJ mol(-1)). To explain this, we suggest a simple protein model inv

1. Human activities have promoted the spread of species worldwide. Several crayfish species have been introduced into new areas, posing a threat to native crayfish and other biota. Invader success may depend on the ability to utilise a wide variety of habitats and resources. Successful invaders are generally expected to have broader niches and to be more plastic than non-invasive species. 2. Using

We investigated effects of concurrent cognitive task difficulty (n-back) on the regularity of whole-body movements during treadmill walking in women and men from 3 age groups (20-30, 60-70, and 70-80 years old). Using principal component analysis of individual gait patterns, we separated main (regular) from residual (irregular) components of whole-body motion. Proportion of residual variance (RV)

Abstract Background: Transcatheter aortic valve implantation (TAVI) has emerged as a treatment for patients with aortic stenosis (AS) and high surgical risk. To date, reports of short- and mid-term survival have been favourable. The aim of this thesis was to evaluate early safety, risk assessment and late survival following TAVI. Methods: In this work we studied clinical outcome, prediction of 3

Control of the grain size in a material is vital in many engineering applications. Evolving through recrystallization, the grain size is strongly influenced by the presence of impurity particles. These particles exert drag forces on migrating grain boundaries and prevent grain boundary motion by pinning of the boundaries. Taking copper as example material, the present work establishes a novel simu

”Alltså säg inte mötesplats! Och möjlighet! Alltså dom här M-orden har jag egentligen lite svårt för liksom. Och mångkultur!”Tjänstemannen blir plötsligt irriterad. Hon brinner för mångfald i kulturlivet, men retoriken, orden och jargongen gör henne frustrerad. Den här avhandlingen handlar till stor del om dessa ord och hur personer som arbetar med teater och integration förhåller sig till dem. TeThe purpose of this thesis is to investigate the notion of multiculturalism in relation to theatre and drama. In Swedish public discourse, culture and the arts are frequently referred to as a social glue which keeps society together. In this context theatre holds a particular position. On the one hand theatre is looked upon as a magic key capable of opening up all sorts of discriminatory structure

The past few decades have witnessed the development of numerous catchment models, often with increasing structural complexity and mathematical sophistication. While such models have certainly provided a better understanding of catchments and associated processes, they are also often catchment-specific, region-specific, or process-specific. Serious concerns on this modeling trend have been increasi

Background: Prostate-specific antigen (PSA) based screening for prostate cancer (PCa) has been shown to reduce prostate specific mortality by 20% in an intention to screen (ITS) analysis in a randomised trial (European Randomised Study of Screening for Prostate Cancer [ERSPC]). This effect may be diluted by nonattendance in men randomised to the screening arm and contamination in men randomised to

In timber housing constructions, vibrations can be a nuisance for inhabitants. Notably, the vibrational response of wooden floor systems is an issue in need of being dealt with more adequately in the designing of such buildings. Studies addressing human response to vibrations are needed in order to be able to better estimate what level of vibrations in dwellings can be seen as acceptable. In the p

BACKGROUND: We present a C++ class library for Monte Carlo simulation of molecular systems, including proteins in solution. The design is generic and highly modular, enabling multiple developers to easily implement additional features. The statistical mechanical methods are documented by extensive use of code comments that - subsequently - are collected to automatically build a web-based manual. R

Background: Cancer of unknown primary (CUP) is diagnosed at a metastatic stage but no diagnostic effort is spared to find the primary cancers because these will guide the treatment. Consequently, the diagnostic work-up for CUP is more comprehensive than for any other cancer, resulting in detection of second cancers unrelated to CUP. We want to use the detection rate of second cancers as a measure

Holmqvist ME, Wedren S, Jacobsson LTH, Klareskog L, Nyberg F, Rantapaa-Dahlqvist S, Alfredsson L, Askling J (Institute of Environmental Medicine, Karolinska Institutet, Stockholm; Karolinska Institutet/Karolinska Hospital, Stockholm; Malmo University Hospital, Malmo; AstraZeneca R&D, Molndal; and Umea University Hospital, Umea, Sweden) Rapid increase in myocardial infarction risk following dia

Background Prostate cancer is one of the leading causes of cancer related deaths. For diagnosis, predicting the outcome of the disease, and for assessing potential new biomarkers, pathologists and researchers routinely analyze histological samples. Morphological and molecular information may be integrated by aligning microscopic histological images in a multiplex fashion. This process is usually

A search is presented for a narrow resonance decaying to a pair of Z bosons using data corresponding to 1.02 fb(-1) of integrated luminosity collected by the ATLAS experiment from pp collisions at root s= 7 TeV. Events containing either four charged leptons (llll) or two charged leptons and two jets (lljj) are analyzed and found to be consistent with the Standard Model background expectation. Lowe

Liquid displacement of model and industrial fluids in pipes was successfully investigated using the in-line rheometer concept based on the combination of Ultrasound Doppler Velocity Profiling (UVP) and the pressure difference (PD) technique. The velocity profile development, related mixing zone and real-time changes in rheology were monitored when one fluid was displaced by another with different

During the years 2006 to 2009, Rare Isotope Spectroscopic INvestigations at GSI (RISING) have focused on high-resolution gamma-ray spectroscopy of exotic nuclear species at rest: following unambiguous discrimination and identification by the FRagment Separator (FRS) and its suite of detectors, the nuclei of interest were implanted in either a passive stopper or a stack of silicon detectors to allo

BACKGROUND: Intense exercise has been reported as one risk factor for hip and knee osteoarthritis (OA). PURPOSE: This study aimed to evaluate (1) whether this is true for both former impact and nonimpact athletes, (2) if the risk of a hip or knee arthroplasty due to OA is higher than expected, and (3) if joint deterioration is associated with knee injuries. STUDY DESIGN: Cohort study; Level of evi