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Binding affinities of the farnesoid X receptor in the D3R Grand Challenge 2 estimated by free-energy perturbation and docking

We have studied the binding of 102 ligands to the farnesoid X receptor within the D3R Grand Challenge 2016 blind-prediction competition. First, we employed docking with five different docking software and scoring functions. The selected docked poses gave an average root-mean-squared deviation of 4.2 Å. Consensus scoring gave decent results with a Kendall’s τ of 0.26 ± 0.06 and a Spearman’s ρ of 0.

Novel multi-target compounds in the quest for new chemotherapies against Alzheimer's disease : An experimental and theoretical study

The lack of any effective therapy along with the aging world population anticipates a growth of the worldwide incidence of Alzheimer's disease (AD) to more than 100 million cases by 2050. Accumulation of extracellular amyloid-β (Aβ) plaques, intracellular tangles in the brain, and formation of reactive oxygen species (ROS) are the major hallmarks of the disease. In the amyloidogenic process, a β-s

Microsoft Word - Litt.lista SPAA20 2022-06-10

Microsoft Word - Litt.lista SPAA20 2022-06-10 Språk- och litteraturcentrum Spanska Litteraturlista SPAA32, Spanska, Fortsättningskurs, 31-60 högskolepoäng Fastställd av Styrelsen för Sektion 3 2024-11-21 att gälla från och med VT25. Delkurs 1. Litteratur, 7,5 hp Obligatorisk kurslitteratur Bombal, María Luisa. La amortajada. Valfri utgåva. (ca 100 s). Enríquez, Mariana. “El chico sucio”, “Tela de

https://www.sol.lu.se/media/utbildning/dokument/kurser/SPAA32/20261/SPAA32_Litt_HT25_1.pdf - 2026-06-04

Memory for hoarded food : An aviary study of the european nuthatch

In an aviary study, each of six male European Nuthatches Sitta europaea was allowed to hoard 30 sunflower seeds in natural hoarding substrates. After eight days, each bird was allowed to search for its cached seeds and its performance compared with that of a bird without previous experience of the specific aviary. In all but one case, the hoarder found significantly more seeds than did the naive b

Repair and Reconstruction of Peripheral Nerve Injuries. Treatment with G-CSF and Stromal Vascular Fraction.

While surgery is a cornerstone in treatment of peripheral nerve injuries, it is not a comprehensive approach, and outcome is unsatisfactory, especially sensory function. The present aim was to translate recent findings about stem- and progenitor cells to improve regenerative outcome, where the cells have to be autologous, available within the same surgical procedure, and minimally manipulated. Gra

To Tender Gender : The Pasts and Futures of Gender Research in Archaeology

Almost 30 years have passed since gender studies entered archaeological discourse in earnest. What is the current status of gender research? One of the aims with this book is to contribute to answering this and other related questions. Another is to shed some light on the pasts and possible futures of gender research.Contributions deal with publication statistics in journals over the last theirty

Catechol-O-methyltransferase (COMT) in rat brain : immunoelectron microscopic study with an antiserum against rat recombinant COMT protein

Localization of catechol-O-methyltransferase (COMT) in rat cerebral cortex, neostriatum and cerebellar cortex was studied with pre-embedding immunoelectron microscopy using a specific antiserum raised against rat recombinant COMT protein. In all areas, immunoreactivity was found both in astrocytes and in neuronal processes. Reaction product was seen in the cytoplasm and in association with tubular

The Simple One-step stool processing method for detection of Pulmonary tuberculosis : A study protocol to assess the robustness, stool storage conditions and sampling strategy for global implementation and scale-up

BACKGROUND: The Xpert MTB/RIF Ultra (Xpert-Ultra) assay provides timely results with good sensitivity and acceptable specificity with stool specimens in children for bacteriological confirmation of tuberculosis (TB). This study aims to optimize the Simple One-Step (SOS) stool processing method for testing stool specimens using the Xpert-Ultra in children and adults in selected health facilities in

Storm chasing : Tracking Holocene storminess in southern Sweden using mineral proxies from inland and coastal peat bogs

Severe extratropical winter storms are a recurrent feature of the European climate and cause widespread socioeconomic losses. Due to insufficient long-term data, it remains unclear whether storminess has shown a notable response to changes in external forcing over the past millennia, which impacts our ability to project future storminess in a changing climate. Reconstructing past storm variability

Steps Control the Dissociation of CO2 on Cu(100)

CO2 reduction reactions, which provide one route to limit the emission of this greenhouse gas, are commonly performed over Cu-based catalysts. Here, we use ambient pressure X-ray photoelectron spectroscopy together with density functional theory to obtain an atomistic understanding of the dissociative adsorption of CO2 on Cu(100). We find that the process is dominated by the presence of steps, whi

Development of 3D geoelectrical resistivity for mapping of gas migration in landfills

Methane is a powerful greenhouse gas and growing concern regarding global climate changes and landfill gas is regarded as one of the major sources for methane migration to the atmosphere. In this study we present research work with the objective to evaluate the use of 3D geoelectrical resistivity to detect gas migration in landfills. Extensive field experiments were conducted at the Filborna landf

Fully unconstrained non-collinear magnetism in triangular Cr and Mn monolayers and overlayers on Cu(111) substrates

A recently developed fully unconstrained approach to non-collinear magnetism has been applied to the investigation of the magnetic ground state of triangular free-standing Cr and Mn monolayers and overlayers on Cu(111) substrates. Such systems represent a physical realization of a frustrated two-dimensional antiferromagnet. We find that the ground state of the Cr monolayers is non-collinear; it sh

Water quality in the Apac, Mbale & Lira districts, Uganda : a field study evaluating problems and suitable solutions

Safe water is a widespread problem in developing countries. In 2004 The United Nations formed the Lake Victoria Region Water and Sanitation Initiative, which focuses on increasing the water quality and basic sanitation in both rural- and urban areas. The government of Uganda is a part of the initiative, since the quality of the drinking water in the country persists to be a widespread problem. In

Is pregnancy planning associated with background characteristics and pregnancy-planning behavior?

Introduction Prevalence of planned pregnancies varies between countries but is often measured in a dichotomous manner. The aim of this study was to investigate to what level pregnant women had planned their pregnancies and whether pregnancy planning was associated with background characteristics and pregnancy-planning behavior. Material and methods A cross-sectional study that utilized the baselin