Archive | ChemRxiv | Cambridge Open Engage

10.26434/chemrxiv-2024-prw8k-v2

Posted

Feb 03, 2025

Robert-Cristian Raclea, Marius Mewald, Kolby L. White, Mohammad Movassaghi

Total Synthesis of (+)-Hazuntiphylline, (–)-Anhydrohazuntiphyllidine, and (–)-Hazuntiphyllidine

10.26434/chemrxiv-2025-75jk6-v2

Posted

Feb 03, 2025

Mari C. Mañas-Torres, Paola Alletto, Simone Adorinni, Attilio Vargiu, Luis Alvarez de Cienfuegos, Silvia Marchesan

Racemic peptide assembly boosts biocatalysis

10.26434/chemrxiv-2025-0vknv

Posted

Feb 03, 2025

Edgar Olehnovics, Yifei Michelle Liu, Nada Mehio, Ahmad Sheikh, Michael Shirts, Matteo Salvalaglio

Accurate Lattice Free Energies of Packing Polymorphs from Probabilistic Generative Models

10.26434/chemrxiv-2024-1lm95-v3

Posted

Feb 03, 2025

Organometallic Chemistry

Arun Asundi, Roel Bienenmann, Daniel Broere, Ritimukta Sarangi

X-ray Spectroscopy Characterization of Electronic Structure and Metal-Metal Bonding in Dicobalt Complexes

10.26434/chemrxiv-2024-dmm7x-v2

Posted

Feb 03, 2025

Materials Chemistry

Artiom Skripka, Emory Chan

Unraveling the Myths and Mysteries of Photon Avalanching Nanoparticles

10.26434/chemrxiv-2024-70qxn-v2

Posted

Feb 03, 2025

Daniel Gutiérrez-Martín, Áurea Varela, Almudena Torres-Pardo, María Hernando, Emilio Matesanz, José María González-Calbet, David Portehault, Marina Parras

BaNiO3 electrocatalysts for oxygen evolution reaction: the role of synthetic methods

10.26434/chemrxiv-2024-n8bj6-v2

Posted

Feb 03, 2025

Materials Chemistry

Sofia Kolin, Moritz Marquardt, Gotthold Fläschner, Stefan Naumann, Kristyna Pluhackova

Molecular determinants of solvent nanoseparation by nanoporous carbon materials

10.26434/chemrxiv-2025-0p0zz

Posted

Feb 03, 2025

Greta Charlotte Dahm, Usman Akhtar, Alix Bouvier-Müller, Laura Lim, Fabienne Levi-Acobas, Pierre Nicolas Bizat, Germain Niogret, Julian Tanner, Frédéric Ducongé, Marcel Hollenstein

Probing three-dimensional cyclooctatetraene as nucleobase modification in aptamer selection

10.26434/chemrxiv-2025-cglxw

Posted

Feb 03, 2025

Daniel Biri, Ashwin Kumar Rajagopalan, Marco Mazzotti

Autonomous Control of Crystal Size and Shape in Dense Suspensions via Imaging

10.26434/chemrxiv-2025-ft8mt

Posted

Feb 03, 2025

Chemical Education

Timothy Schwantes, Dylan Medina, Brittney Morgan, Abhinandan Banerjee

Green beginnings: creating an affordable advanced enquiry-based experimental nanochemistry learning module with catalytically active ‘green’ iron oxide nanoparticles (IONPs)

10.26434/chemrxiv-2025-d4vtl

Posted

Feb 03, 2025

Eduardo Garcia-Padilla, Guanqi Qiu

Global Kinetic-Thermodynamic Responses: Derivation of a General Non-Linear Equation and Demonstrations on Chemical Reactions

10.26434/chemrxiv-2025-5v2bj

Posted

Feb 03, 2025

Lukas Forschner, Jan-Luca Gembus, Lars Schücke, Peter Awakowicz, Andrew R. Gibson, Timo Jacob, Albert Kilian Engstfeld

Statistical Analysis of the Dynamic Behavior of Individual Discharges During the Ignition and Continuous Phases of Contact Glow Discharge Electrolysis

10.26434/chemrxiv-2025-2v2p7

Posted

Feb 03, 2025

Jakub Wosik, Chaoyi Zhu, S. Hessam M. Mehr

A framework for general-purpose chemical synthesis in the aerosol phase and its automated implementation in an open hardware platform

10.26434/chemrxiv-2025-mkmn0

Posted

Feb 03, 2025

Analytical Chemistry

Peter Skrdla, Peter Simon

Isoconversional Methods of Thermal Analysis are Incompatible with Turnbull-Fisher Kinetics: Case Study of Crystallization of Piperine from the Melt

10.26434/chemrxiv-2025-jbvlq

Posted

Feb 03, 2025

Nanoscience

Ayari Yamada, Daichi Eguchi, Tokuhisa Kawawaki, Yuichi Negishi, Naoto Tamai

Structure–Property Relationship between Copper Ions and Hot Electron Relaxation in Colloidal Quantum Dots

10.26434/chemrxiv-2025-6ngh9

Posted

Feb 03, 2025

Jonathan M. Mauß, Klara S. Kley, Rohini Khobragade, Nguyen-Khang Tran, Jacopo De Bellis, Ferdi Schüth, Matthias Scheffler, Lucas Foppa

Modelling the Time-Dependent Reactivity of Catalysts by Experiments and Artificial Intelligence

10.26434/chemrxiv-2025-vf7hd

Posted

Feb 03, 2025

Nikolaos - Angelos Stamos, Benjamin Ries, Regina Schneider, Pavleta Tzvetkova, Florian Montel, Christian Jandl, Ulrike Werthmann

Beyond Barriers, Big Crystallisation Hurdles: Atropisomerism in bRo5 Compounds Explored by Computational and NMR Studies

10.26434/chemrxiv-2025-rz4q6

Posted

Feb 03, 2025

Beta Achromi Nurohmah, Motonori Washisaka, Tsuyoshi Kawai, Tsumoru Morimoto

Photorelease Reaction of Alcohol from 1,4-Naphthoquinone-based Photodegradable Molecules

10.26434/chemrxiv-2025-0tls5

Posted

Feb 03, 2025

Hong Thu Duong, Bruno Ortner, Alexander Sutor, Bastien Oliver Burek, Jonathan Bloh

Intensification of Heterogeneous Photocatalytic Reactions using Wireless Light Emitters: The Case Study of Nitrobenzene Reduction

10.26434/chemrxiv-2025-lbw1b

Posted

Feb 03, 2025

A3A-ligand evolution against anti-hypermutational human metastasis

julio coll

10.26434/chemrxiv-2025-0tc6t

Posted

Feb 03, 2025

Reza Sabouri, Bradley Ladewig, Nicholaus Prasetya

A Comprehensive Review and Evaluation of the Hydrogen Separation Performance of Mixed Matrix Membranes

10.26434/chemrxiv-2025-3fw6x

Posted

Feb 03, 2025

Theodore A. Chavkin, Leonardo D. Gonzalez, Brenda Cansino-Loeza, Rebecca Larson, Brian F. Pfleger, Victor M. Zavala

Co-Design of Cyanobacteria Mutant Strains and Processes for Phosphorus Recovery from Livestock Wastewater

10.26434/chemrxiv-2025-3n9sd

Posted

Feb 03, 2025

Natasha Perry, Gerold Schmitt-Ulms, Pavel Nagorny

Development of CPA-Catalyzed b-Selective Reductive Amination of Cardenolides for the Synthesis of Hydrolytically Stable Analogs

10.26434/chemrxiv-2025-6tnwz

Posted

Feb 03, 2025

Léo Sifringer, Daniel Laguna, Michel Sommer, Janos Vörös

A Multilayer Template Stripping Transfer Printing Method for Engineered Stretchable Electronics

10.26434/chemrxiv-2025-pqnlq-v2

Posted

Feb 03, 2025

Maria Lígia Sousa, Leonor Ferreira, Dora Ferreira, Abel M Forero, Raquel Castelo-Branco, Nikoletta Szemerédi, Gabriella Spengler, Jaime Rodríguez, Carlos Jiménez, Pedro N Leão, Vitor Vasconcelos, Mariana Reis

Decoding Lusichelins A-E: An In-Depth Look at the Metallophores of Lusitaniella coriacea LEGE 07167 – Structure, Production, and Functionality

10.26434/chemrxiv-2025-63fgd

Posted

Feb 03, 2025

Analytical Chemistry

Stuart Ibsen, Alaric William Taylor, Luis Antonio Serrano González, Christian Siebel, Elena Marangon, Giuseppe Toffoli, Joachim Boos, Stefan Guldin

Self-Contained Cartridge for Thin Layer Chromatography Based Quantification of Chemotherapy Concentration in Human Clinical Plasma Samples

10.26434/chemrxiv-2025-m6dzz

Posted

Feb 04, 2025

Yash Mishra, Dara Kiran, Hari Mahalingam

Development and Assessment of Boron, Cerium, and Silver Ternary-Doped Titanium Dioxide Photocatalysts for the UV-A Degradation of Ciprofloxacin Antibiotic

10.26434/chemrxiv-2025-0z4rr

Posted

Feb 04, 2025

Dana O'Connor, Paola Buitrago

Examining the Influence of Graph Representation on Property Prediction of Polymorphic Organic Molecular Crystals

10.26434/chemrxiv-2025-9xjh5

Posted

Feb 04, 2025

Earth, Space, and Environmental Chemistry

Kedong Gong, Sandhya Sethuraman, Zifeng Tang, V. Faye McNeill, Vicki Grassian

Size Dependent Uncatalyzed Sulfite Oxidation in Aqueous Microdroplets

10.26434/chemrxiv-2025-ww7xd

Posted

Feb 04, 2025

Eszter Kozma, Ágnes Szatmári, Tibor Novák, György Török, Ivana Nikić-Spiegel, Attila Kormos, Gergely B. Cserép, Alexandra Egyed, Ágnes Horváth, Krisztina Németh, Réka Kereszty, Elvira Czvik, Miklós Erdélyi, Péter Kele

Toward Far-red Emitting Chemogenetic Labelling for Live Cell Super-Resolution Microscopy using Fluorescence-Activating and Absorption-Shifting Tag

10.26434/chemrxiv-2025-k7vd4

Posted

Feb 04, 2025

Organometallic Chemistry

Roman Belli, Jenna Humke, Sanu Pullarat, Erin Plasek, Sallu Kargbo, Courtney Roberts

Expanding Access to Previously Inaccessible 5-Membered N-Heteroarynes

10.26434/chemrxiv-2024-p68lm-v2

Posted

Feb 04, 2025

Kariana Moreno Sader, Sayandeep Biswas, Rob Jones, Marian Mennig, Reza Rezaei, William H. Green

Battery Electric Long-Haul Trucking in the United States: A Comprehensive Costing and Emissions Analysis

10.26434/chemrxiv-2023-48zsc-v2

Posted

Feb 04, 2025

Kavisha A. Sarma, Isis A. Middleton, Man H. Chak, Jake P. Violi, Mohan Bhadbhade, Jonathon Beves

Ruthenium(II) complexes with photoswitchable and photoejectable ligands

10.26434/chemrxiv-2025-3sffc

Posted

Feb 04, 2025

Kristian Torstensen, Florian Sixt, Abraham Alemayehu, Nicholas S. Settineri, Abhik Ghosh

Doubly Stereogenic Sandwich Compounds: Separation and Characterization of Diastereomeric Metallobiscorroles

10.26434/chemrxiv-2025-2xq3l

Posted

Feb 04, 2025

Baptiste Py, Zilong Wang, Francesco Ciucci, Yuhao Wang

Entropy-based Regularized Regression for Advanced Distribution of Relaxation Times Deconvolution

10.26434/chemrxiv-2025-n6d9n

Posted

Feb 04, 2025

Gabriela Valle-Núñez, Raziel Cedillo-González, Juan F. Avellaneda-Tamayo, Fernanda I. Saldívar González, Diana L. Prado-Romero, José L. Medina-Franco

Machine learning-driven antiviral libraries targeting respiratory viruses

10.26434/chemrxiv-2025-bwdjj

Posted

Feb 04, 2025

Rosmi Reji, Juan P. Vizuet, Xiaoli Yan, Biki Behera, Xin Zheng, Matthew Klenk, Nicholas P. Weingartz, George T. Kostopoulos, Lin X. Chen, Neeraj Agarwal, Peter Zapol, Eliu A. Huerta, Murat Keceli, Ksenija Glusac

Product Selectivity in Photochemical CO2 Reduction by a Post-synthetically Modified Zr-MOF

10.26434/chemrxiv-2025-jjcbv

Posted

Feb 04, 2025

Mengqi TANG, Alexandre Chevillot-Biraud, Stéphanie Lau-Truong, Ahmed Mohamed Khalil, Mohamed Mehdi Chehimi

Understanding the pyrolysis-assisted conversion of metal salt-impregnated biomass into biogas and nanocatalyst-coated porous biochar

10.26434/chemrxiv-2025-s2s0r

Posted

Feb 04, 2025

Michael Liesen, Ryan Hayes, Charles Brooks, Jonah Vilseck

Multiple Molecule λ-Dynamics: Probing Drug Resistance with Concurrent Protein and Ligand Perturbations

10.26434/chemrxiv-2025-m0129

Posted

Feb 04, 2025

Nitesh Tripathi, Arnab Chowdhury, Neelam Verma, Anupam Bandyopadhyay

Introducing the potential binding interface between the TRAIL-mimicking peptide and DR5 via alanine scan

10.26434/chemrxiv-2025-x2921

Posted

Feb 04, 2025

Alexandre Ferreira, Rui Guo, Ivan Marziano, Matteo Salvalaglio

A Gridless Approach to Sampling and Classifying High-Dimensional Conformational Landscapes of Active Pharmaceutical Ingredients

10.26434/chemrxiv-2025-j2n83

Posted

Feb 04, 2025

Aida Fica, McKayla Torbett, Samuel West, Malika Rao, Raman Dhiman, Jun Wang, Yang Gao, Yu-Ming Tu, Harekrushna Behera, Claude Roc, Kyler Grogan, Benjamin Keitz, Robert Hickey, Adrianne Rosales, Berkin Dortdivanlioglu, Stephen Sarles, Manish Kumar

3D-printable bilayer-stabilized jammed emulsions as scalable biological tissue mimics

10.26434/chemrxiv-2025-xccxm

Posted

Feb 04, 2025

PROPERTIES, EFFECTS AND CHEMICAL & BIOLOGICAL METHOD OF SYNTHESIS OF SILVER NANOPARTICLES

VARUN MALI

10.26434/chemrxiv-2025-kclgf

Posted

Feb 04, 2025

Maximilian Fleck, Timo Klenk, Samir Darouich, Marcelle B M Spera, Niels Hansen

A Generalized Deep Entropy Scaling Architecture Framework to Predict Viscosities

10.26434/chemrxiv-2025-jrjj9

Posted

Feb 04, 2025

Polymer Science

Yiwen Zheng, Vikas Varshney, Aniruddh Vashisth

Accelerated ReaxFF Simulations of Vitrimers with Dynamic Covalent Adaptive Networks

10.26434/chemrxiv-2025-5vptv

Posted

Feb 04, 2025

Kosuke Yasui, Masayuki Miyaoka, Yuichiro Tomishima, Koji Hirano

Stereoselective Generation and Use of α-Fluorovinyl Radicals via Mesolytic Cleavage of C(sp2)–S Bond of α-Fluorovinyl Sulfoximines

10.26434/chemrxiv-2025-1kzz4

Posted

Feb 04, 2025

Analytical Chemistry

Shinnosuke Horiuchi, Shota Ogura, Kazuya Otsubo, Yuka Ikemoto, Hisao Kiuchi, Go Watanabe, Osamu Takahashi, Mikihiro Hayashi, Eri Sakuda, Yasuhiro Arikawa, Keisuke Umakoshi, Yoshihisa Harada

Low-entropy Supramolecular Crystals: Elucidating the Inhomogeneity of Interfacial Water Molecules at Atomic Resolution

10.26434/chemrxiv-2025-gl0qz

Posted

Feb 04, 2025

Woei Jer Ng, Aydar Rakhmatullin, Kateryna Goloviznina, Mathieu Salanne, Catherine Bessada

Structural Dynamics of Molten NaCl–MgCl2–LaCl3: A Proxy for Molten Chloride Fast Reactor Fuels

10.26434/chemrxiv-2025-q6l1t

Posted

Feb 04, 2025

Claudia F. Echavarría, Daniel Kocsi, Mohamed Abdellah, Starla Glover, Sara H Mejias

The relevance of amino acid-chromophore interactions in protein conformational changes and their impact on chromophore relaxation dynamics

10.26434/chemrxiv-2025-5krws

Posted

Feb 04, 2025

Polymer Science

Basic Concepts and Tools of Artificial Intelligence in Polymer Science

khalid ferji

10.26434/chemrxiv-2025-tk6hx

Posted

Feb 04, 2025

André Matthew R. Tayamen, Sam Amsterdam, Wesley Chang

A model-informed analysis of battery electrodes using non-contact air-coupled ultrasound

10.26434/chemrxiv-2025-957c0

Posted

Feb 04, 2025

Solomon Attionu, Rita Dill, Michael Summers, David Case, Jan Marchant, T Kwaku Dayie

Enhanced Line Narrowing of Selectively Labeled [9-15N] Guanosine Enables Probing of Large RNAs

10.26434/chemrxiv-2025-hftft

Posted

Feb 04, 2025

Nanoscience

Laura Bourdon, Gerrit David Wilkens, Samy Dehissi, Salammbô Hotte, Sergii Rudiuk, Mathieu Morel, Ayako Yamada, Gaëtan Bellot, Damien Baigl

Minutes-timescale in situ assembly of DNA origamis with living cells

10.26434/chemrxiv-2025-mh3k7

Posted

Feb 05, 2025

Daniel Manhouli Daawe, Cedric Karel Fonzeu Monguen, Stephane Kenmoe, Patrick Kouotou Mountapmbeme

Investigation of Mn-doping effects on the structural, morphological, thermal, and catalytic properties of Co3O 4 spinel nanoparticles towards CO oxidation

10.26434/chemrxiv-2025-v6kxz

Posted

Feb 05, 2025

Niklas von Rhein, Jian Liang Low, Charlotte Gallenkamp, Beate Paulus, Vera Krewald

Pyrrolic FeN4 models for FeNC catalysts: the influence of planarity on electronic properties and Mössbauer parameters

10.26434/chemrxiv-2025-9hstm

Posted

Feb 05, 2025

Runhan Shi, Chi Zhang, Gufeng Yu, Xiaohong Huo, Yang Yang

ChiralFinder: Automated Detection of Stereogenic Elements and Discrimination of Stereoisomers in Complex Molecules

10.26434/chemrxiv-2025-wz7kh

Posted

Feb 05, 2025

Sree Chithra, Corentin Pigot, Claire Tonnelé, David Casanova, Victor Gray

Chemical Insights to the Electron Transfer from the Triplet Pair State in Singlet Fission Dimers

10.26434/chemrxiv-2025-jw8kc

Posted

Feb 05, 2025

Dario Gomez Vazquez, Travis P. Pollard, Oleg Borodin, Maria R. Lukatskaya

Measuring Zn Transference with Precision: Insights for Dendrite-Free Zinc Metal Anodes

10.26434/chemrxiv-2025-2zrpp

Posted

Feb 05, 2025

Ioannis Kanavos, Douglas Nakahata, Madeleine Barrett, Ancély Ferreira dos Santos, Maria Zubiria-Ulacia, German Pieslinger, Ana Beatriz da Silva Teixeira, Clarissa Rocha, Jonas Eberle, Ryszard Lobinski, Jon Matxain, Matthew Hall, José Pedro Friedmann Angeli, Elias Arnér, Luisa Ronga, Raphael de Paiva

Selective Arylation of Se vs. S by Gold Compounds: Consequences for GPx Inhibition and A375 Sensitivity

10.26434/chemrxiv-2025-h2pz5

Posted

Feb 05, 2025

Konstantin Stracke, Babak Farhadi Jahromi, Guido H. Clever, Rochus Schmid

A Collective Variable for the Control of Solvation in Cage Compounds

10.26434/chemrxiv-2025-r8sgw

Posted

Feb 05, 2025

Luis M. Negrón, Edwin Vázquez-Rosa, Luxene Belfleur, Tanya L. Díaz, Bismark Madera-Soto, Irving E. Vega, Jose M. Rivera

Guanosine-based supramolecular particles for enhanced drug and gene delivery in cell culture

10.26434/chemrxiv-2025-qm64k

Posted

Feb 05, 2025

Arturo Sauza-de la Vega, Andrea Darù, Stephanie Nofz, Laura Gagliardi

Designing Molecular Qubits: Computational Insights into First-Row and Group 6 Transition Metal Complexes

10.26434/chemrxiv-2025-3tg1x-v2

Posted

Feb 05, 2025

Marie-Hélène Pietraru, Antonin Homassel, Emmanuel Nicolas, Thibault Cantat

Simplified carbonylation catalyst based on [Co2(CO)8] and coordinating solvents for the carbonylation of β-lactones and α,β-unsaturated acids to cyclic anhydrides

10.26434/chemrxiv-2024-07h4m-v2

Posted

Feb 05, 2025

On the Photosensitizing Properties of Aloe-Emodin in Photodynamic Therapy: Insights from the Molecular Modeling

Maciej Spiegel

10.26434/chemrxiv-2025-spzw3-v3

Posted

Feb 05, 2025

Nanoscience

Rina Mishima, Takuro Nagai, Hiroyo Segawa, Masahiro Ehara, Takashi Uchino

Atomic-Scale Observation of Moiré potential in Twisted Hexagonal Boron Nitride Layers by Electron Microscopy

10.26434/chemrxiv-2024-hbbfj-v2

Posted

Feb 05, 2025

Debtanu Maiti, Michael Harold, Lars Grabow

Single atom alloys 2.0: Exploiting undercoordination for stronger dissociative CH4 chemisorption

10.26434/chemrxiv-2024-vhmz3-v2

Posted

Feb 05, 2025

Pravat Nayek, Buddhadeb Pal, Prasenjit Mal

Visible-Light Photocatalysis Using CsPbX3 Perovskite Nanocrystals for Organic Transformations

10.26434/chemrxiv-2025-vdjb1-v2

Posted

Feb 05, 2025

Christian Chaheine, Louis Conway, Christopher Parker

Fully-Functionalized Natural Product Probes to Expand the Chemical Tractability of the Human Proteome

10.26434/chemrxiv-2025-hfmv4-v2

Posted

Feb 05, 2025

Xin Zheng, Nikita Gupta, Haiying He, Jasleen K. Bindra, Subharaj Hossain, Juan P. Vizuet, Atefeh Nadeali, Danial Zangeneh, Roushan Prakash Singh, Robert F. Klie, Brian P. Chaplin, Kenneth Brezinsky, Oleg G. Poluektov, Jens Niklas, Peter Zapol, Ksenija D. Glusac

Novel Light-Responsive Metal-Organic Framework with Perchlorinated Nanographene Ligands

10.26434/chemrxiv-2025-pl8s1

Posted

Feb 05, 2025

Jose Ruiz, Dylan Turner, Mingchun Gao, Wentao Guo, Tania Shahvali, Emily Jimenez Andrade, Kevin Kong, Beck Miller, James Fettinger, Matthew Sigman, Dean Tantillo, Jared Shaw

Enantioselective Synthesis of Complex Carbocycles by Donor/Donor Carbenes C-H insertion

10.26434/chemrxiv-2025-b1fh6

Posted

Feb 05, 2025

Federico Caimi, Juliette Langlais, Francesco Fontana, Sreekar Wunnava, Tommaso Bellini, Dieter Braun, Tommaso Pietro FRACCIA

High-yield prebiotic polymerization of 2’,3’-cyclic nucleotides under wet-dry cycling