This work demonstrates that a WD-containing peptide from coronin 1, a phagosomal protein, can inhibit membrane fusion by modulating membrane organization and dynamics. The paper discusses a new way of developing entry inhibitors. Hirak Chakraborty
go.acs.org/9MM

📢 Call for Papers 📢This Virtual Special Issue will cover and explore fundamental, theoretical, and applicative aspects of non-fluorescence-based single-particle methods. Submit your manuscript by July 31, 2024. 🔗 go.acs.org/9MB

Deep learning used to predict defect properties in semiconductors, integrating results with defect thermodynamics and device simulation. This approach can be used to optimize doping, enhance device performance, and accelerate material discovery. UW Molecular Engineering Materials Center
go.acs.org/9Ml

The topological design of molecular clusters endows pure nanoparticle systems with hierarchical structural relaxation dynamics and broadly tunable viscoelasticity, which was considered to be the unique features of polymers.
go.acs.org/9LZ

#ICYMI Take this opportunity to submit your work to a Virtual Special Issue from #JCIM JCIM & JCTC Journals and The Journal of Physical Chemistry B 📝 Applications of Free Energy Calculations to Biomolecular Processes 🔬✍

Submit your work by Jul 31 🔔🔗 go.acs.org/9LP

A systematic study on protein-RNA complexes using all-atom MD simulations highlighted the crucial role of the interface dynamics and alternative interfaces. Elisa Frezza 🇮🇹🇫🇷 Juliette Martin
go.acs.org/9LM

Visible light can be used to selectively modulate the rates of individual redox reactions in nanoparticle synthesis in ways that are orthogonal to purely thermochemical synthetic approaches, enabling enhanced control of shape and composition Michelle Personick
go.acs.org/9LB

Single photoelectron ring was observed for M@Ag12- (M = V, Nb, Ta) providing unambiguous fingerprint of icosahedral symmetry of their geometrical structures. This is an ideal textbook example of spherical jellium model for metal clusters Kyushu University
go.acs.org/9KX

Prof. Aloke Das and his team from IISER Pune (IISER Pune Prakash Panwaria Aloke Das CHEMIISERP) have probed the N∙∙∙C=O n→π* interaction for the first time from gas phase high-resolution electronic and vibrational spectroscopy.
go.acs.org/9KE

See how to use molecular dynamics simulations with chromatography resin fragments for qualitative prediction of interaction sites (specificity) and retention times (affinity) of a protein for a given chromatography resin. Johnson & Johnson J&J Innovative Medicine
go.acs.org/9Kn

Solvatochromism of 2D Materials in Solvents: To be or not to be shifted— that is the question for the emission wavelength. m-design Lab KAIST KAIST Chemistry
go.acs.org/9Ka

New parameter-free electron propagators predict electron affinities & ionization energies with faster (cubic/quintic) scaling & higher (.1 eV) accuracy than their predecessors. Composite-model EA errors ~ .05 eV for photovoltaic molecules! 〈Ernest | Opoku〉
go.acs.org/9JV

This new Collection highlights our favorite special articles written by invited authors and published in The Journal of Physical Chemistry C in 2023. Browse the collection 🔗 go.acs.org/9JO

Electrochemically converting glucose to valuable derivatives shows potential for renewable carbon usage. This study explores key factors affecting the oxidation process using gold disk RDE-setup. Findings: selective oxidation patterns and DFT insights.
go.acs.org/9Jv

Surface-enhanced Raman spectroscopy has been used to observe, for the first time, the localized excitation of vibrational modes in adsorbates, under exposure to a low-temperature plasma.
go.acs.org/9Jk

A stereoselective interaction and distinct binding mode in homochiral and heterochiral systems of chiral carbon dots and chiral ligands enable an advanced platform for chiral sensing applications by preferential chiral selective charge flow.
go.acs.org/9Jd

Having trouble encapsulating suspensions of mobile particles? Try density matching. Wilson-Whitford and Gilchrist demonstrate the encapsulation of non-Brownian particle suspensions using solvent-particle density matching. James Gilchrist Lehigh ChBE
go.acs.org/9J3

This work highlights that #ML potential with low test error does not guarantee good performance for the simulations. The study solves this problem by training ML potentials to directly improve performance in simulations. Pavlo Dral
go.acs.org/9IX

Catalysts riding the perfect wave are more productive than ones sitting still. This work shows how to use optimization to find the perfect wave for catalyst surfaces to maximize their activity. Profess.or Profess.and Carnegie Mellon Chemical Engineering
go.acs.org/9IT

Ultrafast pump probe spectroscopy revealed the plasmon induced ultrafast hot hole from non-stoichiometric CIS to CdS in CIS/CdS heterostructure. @HnGLaboratory Nitika kharbanda Manvi
go.acs.org/9IL