A new synthetic access to furo[3,2-f]chromene analogues of an antimycobacterial

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The field of protein design has made remarkable progress over the past decade. Historically, the low reliability of purely structure-based design methods limited their application, but recent strategies that combine structure-based and sequence-based calcu ...

The synthesis of complex sugars is a key aspect of microbial biology. Cyclic beta-1,2-glucan (C beta G) is a circular polysaccharide critical for host interactions of many bacteria, including major pathogens of humans (Brucella) and plants (Agrobacterium). ...

Proteins, the central building blocks of life, play pivotal roles in nearly every biological function. To do so, these macromolecular structures interact with their surrounding environment in complex ways, leading to diverse functional behaviors. The predi ...

Exploring a wide range of design options is crucial for every sound conceptual design process. In the conventional structural design workflow, optimization techniques are generally employed to generate well-performing design options. However, focusing only ...

The binding and catalytic functions of proteins are generally mediated by a small number of functional residues held in place by the overall protein structure. Here, we describe deep learning approaches for scaffolding such functional sites without needing ...

DNA-based nanostructures are actively gaining interest as tools for biomedical and therapeutic applications following the recent development of protective coating strategies prolonging structural integrity in physiological conditions. For tailored biologic ...

Urease converts urea into ammonia and carbon dioxide and makes urea available as a nitrogen source for all forms of life except animals. In human bacterial pathogens, ureases also aid in the invasion of acidic environments such as the stomach by raising th ...

A promising approach to influence and control the photophysical properties of conjugated polymers is directing their molecular conformation by templating. We explore here the templating effect of single-stranded DNA oligomers (ssDNAs) on cationic polythiop ...

Electrochemical reduction of carbon dioxide is one of the plausible approaches towards renewable energy carriers. When coupled with electricity, which can be provided by sustainable technologies, it becomes a method of high importance with potential value ...

In the last decade, Ultra High Performance Fibre Reinforced cement-based Composites (UHPFRC) have been increasingly implemented for rehabilitation and strengthening purposes, rendering outstanding results. The ease of application, along with their superior ...

Nuclear Magnetic Resonance (NMR) spectroscopy is particularly well suited to determine the structure of molecules and materials in powdered form. Structure determination usually proceeds by finding the best match between experimentally observed NMR chemica ...

We present the X-Shell pavilion, a lightweight structure composed of elastic beam elements joined in a special layout that allows easy on-site deployment. The structure’s undeployed assembly configuration lies mostly flat and is easy to build, consisting o ...

The hierarchy of propositions has been accepted amongst the forensic science community for some time. It is also accepted that the higher up the hierarchy the propositions are, against which the scientist are competent to evaluate their results, the more d ...

Bacteriophages of the myoviridae family, R-type pyocin, Photorhabus virulence cassette (PVC), Serratia antifeeding prophage (Afp) and type 6 secretion system (T6SS) form a class of contractile injection systems that share common structural and functional c ...

The pivotal theory of molecular biology states that the structure of biomolecules is directly related to their function in living systems. In this way, the structural investigation of biological molecules allows understanding and intervening in the fundame ...

Origami manufacturing has led to considerable advances in the field of foldable structures with innovative applications in robotics, aerospace, and metamaterials. However, existing origami are either load-bearing structures that are prone to tear and fail ...

Proteins undergo both cold and heat denaturation, but often cold denaturation cannot be detected because it occurs at temperatures below water freezing. Proteins undergoing detectable cold as well as heat denaturation yield a reliable curve of protein stab ...

In the first part of this thesis, we present and compare several approaches for the determination of the steady-state of large-scale Markov chains with an underlying low-rank tensor structure. Such structure is, in our context of interest, associated with ...

This paper is a discussion of a recent publication by Sekkal and coworkers, which investigated the elasticity, cohesion, and stability of the C-S-H (001) surface as a function of porosity using molecular dynamics simulations. In our discussion, we highligh ...

Iron oxide nanoparticles (IONPs) were synthesized by a novel aqueous synthesis route which combines co-precipitation (CP) and hydrothermal (HT) treatment, termed CP + HT, and compared with IONPs obtained by the standard CP method. Properties of both types ...

A new synthetic access to furo[3,2-f]chromene analogues of an antimycobacterial

Chattez avec Graph Search

Opportunities and challenges in design and optimization of protein function

Structure-function analysis of the cyclic β-1,2-glucan synthase from Agrobacterium tumefaciens

A Geometric Transformer for Structural Biology: Development and Applications of the Protein Structure Transformer

Computational conceptual design — typological exploration of spatial truss systems through optimization

Scaffolding protein functional sites using deep learning

Quantification of Strand Accessibility in Biostable DNA Origami with Single-Staple Resolution

High-resolution cryo-EM structure of urease from the pathogen Yersinia enterocolitica

Structural and Photophysical Templating of Conjugated Polyelectrolytes with Single-Stranded DNA

Rational design of ionic compounds for electrocatalytic reduction of carbon dioxide

Towards the use of UHPFRC in railway bridges: the rehabilitation of Buna Bridge

A Bayesian approach to NMR crystal structure determination

X-Shell Pavilion: A Deployable Elastic Rod Structure

A template for constructing Bayesian networks in forensic biology cases when considering activity level propositions

Structural and functional analysis of host attachment proteins from contractile injection systems

Cryogenic infrared spectroscopy as a probe of structure and dynamics of biomolecules

Bioinspired dual-stiffness origami

The cold denaturation of IscU highlights structure–function dualism in marginally stable proteins

Low-rank tensor methods for large Markov chains and forward feature selection methods

A discussion on the paper "Role of porosity on the stiffness and stability of (001) surface of the nanogranular C-S-H gel"

Controlling structural and magnetic properties of IONPs by aqueous synthesis for improved hyperthermia