In drug discovery, it is of utmost importance to accurately calculate the free energies of binding ligands to various protein targets, such as enzymes and receptors. We have assessed and used computational tools for this aim, most of them based on molecular dynamics (MD) simulations. We mostly used molecular mechanics (MM) in order to model the protein—ligand interactions, which is more approximat

The retail industry faces a multitude of complex sustainability challenges, which calls for transformational change. While the retail industry is a major driver of production and consumption patterns, it also offers significant potential to reduce global greenhouse gas emissions. Notably, logistics services, such as warehousing, delivery, and returns, have gained vital importance in retail due to

This conceptual chapter investigates how knowledge moves across different “social fields” (Bourdieu, 2005b). We propose a certain social Gestalt new knowledge discussion creates the dialogically constructed antenarrative field. An antenarrative field is a social space for knowledge exchange where agents speculate on future scenarios’ potential for realization, and our notion of the antenarrative f

The domestic care work sector in Sweden is growing. The expansion of the welfare state in the post-war period made privately employed domestic workers an uncommon practice (Öberg, 1999). Today, we see a re-emergence of the market. The turning point for this is the RUT tax deduction, introduced in 2007 and leading to a tremendous growth in the sector. Approximately 30 000 people are employed in RUT

This paper investigates the significance of care between generations in Sweden. This is done towards the background of a strong narrative in both popular and sociological discourses depicting the Nordic countries in general, and Sweden in particular, as the ‘most individualized’ society in the world, where the expansive welfare state is seen as having taken over care responsibilities, leading to w

Denna artikel återger och diskuterar resultaten från en undersökning av språkförståelsen hos svenska och danska gymnasieungdomar i Öresundsregionen. Problematiseringen av begreppet grannspråk versus främmande språk ur ett pragmatiskt perspektiv fick stor uppmärksamhet i båda länderna och gav upphov till en konferens med samma titel, anordnad på Lunds universitet av Center for Scandinavian Studies Hvor godt forstår den unge generation af danskere og svenskere hinanden?Ikke særlig godt, ifølge en undersøgelse foretaget i Malmø og København i efteråret 2012 og foråret 2013. De unge synes heller ikke at være synderligt optaget af, hvad der foregår lige ovre på den anden side af Sundet, hvilket er tankevækkende i en tid, hvor mulighederne for at bevæge sig mellem nabolandene aldrig har været be

Recently, several convergence rate results for Douglas-Rachford splitting and the alternating direction method of multipliers (ADMM) have been presented in the literature. In this paper, we show global linear convergence rate bounds for Douglas-Rachford splitting and ADMM under strong convexity and smoothness assumptions. We further show that the rate bounds are tight for the class of problems und

Context. Observational evidence indicates that the orbits of extrasolar planets are more various than the circular and coplanar ones of the solar system. Planet-planet interactions during migration in the protoplanetary disc have been invoked to explain the formation of these eccentric and inclined orbits. However, our companion paper (Paper I) on the planet-disc interactions of highly inclined an

Robust performance of networks of interconnected heterogenous nonlinear dynamic systems is studied using the theory of integral quadratic constraints. By appealing to recent results on chordal sparsity decompositions of rational transfer matrices, distributed and scalable certificates for performance of interconnections are proposed. The approach is more direct since it does not involve reformulat

Avhandlingen fokuserar på ojämförbarhet med avseende på värde. Jag avser att förklara varför det ibland kan vara svårt att jämföra vissa objekt. I min avhandling argumenterar jag för att det är språklig vaghet som ger upphov till ojämförbarhet. Jag diskuterar även andra saker så som: huruvida "bättre än" en transitiv relation, om det finns mer relationer än "bättre än", "sämre än" och "lika bra", This thesis explores whether the three standard value relations, “better than”, “worse than” and “equally as good”, exhaust the possibilities in which things can relate with respect to their value. Or more precisely, whether there are examples in which one of these relations is not instantiated. There are cases in which it is not obvious that one of these relations does obtain; these are referred

The structural phase transition accompanied by a Jahn-Teller switch has been studied over a range of H/D ratios in (NH4)2[Cu(H2O)6](SO4)2 (ACTS). In particular, single-crystal neutron diffraction investigations of crystals with deuteration in the range 50 to 82% are shown to be consistent with previous electron paramagnetic resonance (EPR) experiments exhibiting a phase boundary at 50% deuteration

The effect of doping and diameter on the electrical properties of vapor-liquid-solid grown GaSb nanowires was characterized using long channel back-gated lateral transistors and top-gated devices. The measurements showed that increasing the doping concentration significantly increases the conductivity while reducing the control over the channel potential and shifting the threshold voltage, as expe