Chemical science
Nov 19, 2018
There has been a recent surge of interest in using machine learning across chemical space in order to predict properties of molecules or design molecules and materials with the desired properties. Most of this work relies on defining clever feature r...
Chemical science
Nov 5, 2018
Although a number of advances have been made in RNA sequencing and structural characterization, the lack of a method for directly determining the sequence and structure of single RNA molecules has limited our ability to probe heterogeneity in gene ex...
Chemical science
Nov 2, 2018
In this study, a new biosensor based on a sandwich structure has been developed for the isolation and detection of multiple bacterial pathogens magnetic separation and SERS tags. This novel assay relies on antimicrobial peptide (AMP) functionalized ...
Chemical science
Oct 25, 2018
As the materials science community seeks to capitalize on recent advancements in computer science, the sparsity of well-labelled experimental data and limited throughput by which it can be generated have inhibited deployment of machine learning algor...
Chemical science
Sep 11, 2018
Boron crystals, despite their simple composition, must rank top for complexity: even the atomic structure of the ground state of β-B remains uncertain after 60 years' study. This makes it difficult to understand the many exotic photoelectric properti...
Chemical science
Dec 12, 2017
Molecular crystals play an important role in several fields of science and technology. They frequently crystallize in different polymorphs with substantially different physical properties. To help guide the synthesis of candidate materials, atomic-sc...
Chemical science
Oct 31, 2017
Molecular machine learning has been maturing rapidly over the last few years. Improved methods and the presence of larger datasets have enabled machine learning algorithms to make increasingly accurate predictions about molecular properties. However,...
Chemical science
Oct 23, 2017
Understanding the relationship between the structure of light-harvesting systems and their excitation energy transfer properties is of fundamental importance in many applications including the development of next generation photovoltaics. Natural lig...
Chemical science
Oct 20, 2017
Current chemotherapeutic dosing strategies are limited by the toxicity of anticancer agents and therefore rely on multiple low-dose administrations. As an alternative, we describe a novel sustained-release, biodegradable polymeric nanocarrier as a si...
Chemical science
Oct 5, 2017
Teixobactin is a highly promising antibacterial depsipeptide consisting of four d-amino acids and a rare l--enduracididine amino acid. l--Enduracididine is reported to be important for the highly potent antibacterial activity of teixobactin. However,...