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Subject: Chemistry
,
Working Paper
, Title:

A (poly)Pro tip for preserving native disulfide connectivity during thiol-maleimide bioconjugation of disulfide-rich peptides

, Authors: Lylia Azzoug, Ana Novak, Hervé Meudal, Jean-Baptiste Madinier, Stéphane Charpentier, Karine Loth, Séverine Morisset-Lopez, Carlo Pifferi, Vincent Aucagne
Version undefined posted 02 November 2025
Posted
Nov 02, 2025
10.26434/chemrxiv-2025-krjcm
 
Subject: Chemistry
,
Review
, Title:

Operating limits and Durability of Water electrolyzers

, Authors: MD SAJIB HOSEN, Muhammad Hammad Zaman
Version undefined posted 03 November 2025
Posted
Nov 03, 2025
10.26434/chemrxiv-2025-8rw0g
 
Subject: Chemistry
,
Working Paper
, Title:

Siamese Graph Neural Networks for Melting Temperature Prediction of Molten Salt Eutectics

, Authors: Nila Mandal, James Maniscalco, Mark Aindow, Qian Yang
Version undefined posted 03 November 2025
Posted
Nov 03, 2025
10.26434/chemrxiv-2025-l7gf8
 
Subject: Chemistry
,
Working Paper
, Title:

Hot Electron-Driven Nitrate-to-Ammonia Conversion On Nanocatalyst: Insights from Quantum Dynamics Simulations

, Authors: Dibyajyoti Ghosh, Ankita Kumari, Sergei Tretiak
Version undefined posted 03 November 2025
Posted
Nov 03, 2025
10.26434/chemrxiv-2025-q772j
 
Subject: Chemistry
,
Working Paper
, Title:

Curvature-Dependent Fluorescence Enhancement in π-Conjugated Lipid Membranes

, Authors: Yoo Kyung Go, Nurila Kambar, Zhengzhong Tan, Cecilia Leal
Version undefined posted 03 November 2025
Posted
Nov 03, 2025
10.26434/chemrxiv-2025-4sfkj
 
Subject: Chemistry
,
Working Paper
, Title:

The potential of thermomechanical and thermochemical processes to enable sustainable household sanitation

, Authors: Zixuan Wang, Jianan Feng, Buai Shi, Johanna Arita Mendoza, Xinyi Zhang, Nina Trousdale, Roland Cusick, Shannon Yee, Jeremy Guest
Version undefined posted 03 November 2025
Posted
Nov 03, 2025
10.26434/chemrxiv-2025-gdbqg
 
Subject: Chemistry
,
Working Paper
, Title:

The Sixth CACHE Challenge – A Comprehensive Drug Discovery Workflow to Discover Potential Inhibitors of the Triple Tudor Domain of SETDB1

, Authors: Agathe Fayet, Ahmed Ayoub, Anthony Fejes, Matej Janežič, Yi-Hsuan Lin, Antoine Moitessier, Nicolas Moitessier, Mathew Neal, Joshua Pottel, Ophélie Rostaing, Benjamin Weiser, Jonah Zoldan, Mihai Burai-Patrascu
Version undefined posted 03 November 2025
Posted
Nov 03, 2025
10.26434/chemrxiv-2025-jrtx9
 
Subject: Chemistry
,
Working Paper
, Title:

Orange-Light-Driven Skeletal Editing: Low-Energy Photoredox Furan-to-Pyrrole Conversion

, Authors: Ramandeep Kaur, Luke D. Fasse, Md Mubarak Hossain, Waleed K. Yual, Thomas L. Gianetti
Version undefined posted 03 November 2025
Posted
Nov 03, 2025
10.26434/chemrxiv-2025-xvctc
 
Subject: Chemistry
,
Working Paper
, Title:

Beyond Steady-state Kinetics: Improving Catalytic Activity through Potential Oscillation

, Authors: Ana-Iulia Hutu, Peter V. Hendriksen, Oliver Christensen, Henrik Høgh Kristoffersen, Jan Rossmeisl
Version undefined posted 03 November 2025
Posted
Nov 03, 2025
10.26434/chemrxiv-2025-gh81d
 
Subject: Chemistry
,
Working Paper
, Title:

Activation Mechanism of Jumping Spider Rhodopsin-1 Revealed by Classical Molecular Dynamics

, Authors: Duccio Di Prima, Peter Reinholdt, Jacob Kongsted
Version undefined posted 03 November 2025
Posted
Nov 03, 2025
10.26434/chemrxiv-2025-0gxh1
 
Subject: Chemistry
,
Working Paper
, Title:

Interplay of Redox Non-Innocence and Symmetry Breaking in a 4d Coordination Framework

, Authors: Anton Viborg, Maja Dunstan, Adam Sapnik, Frédéric Aribot, Mariusz Kubus, Nathan Yutronkie, Ivica Zivkovic, Kasper Borup, Zheshen Li, Luis Leyva-Parra, Marc Ubach I Cervera, David Gracia, Diego López-Alcalá, José Baldoví, Fabrice Wilhelm, Vivian Nassif, Bo Iversen, Marco Evangelisti, Henrik Rønnow, Sebastian Reyes-Lillo, Andrei Rogalev, Kasper Steen Pedersen
Version undefined posted 03 November 2025
Posted
Nov 03, 2025
10.26434/chemrxiv-2025-371ln
 
Subject: Chemistry
,
Working Paper
, Title:

Accuracy of the isoconversional principle in thermal analysis of complex condensed phase reactions

, Authors: Alireza Aghili, Andrei A. Stolov
Version undefined posted 03 November 2025
Posted
Nov 03, 2025
10.26434/chemrxiv-2025-6c7fw
 
Subject: Chemistry
,
Working Paper
, Title:

Vanadium Doping of Anisotropic Cobalt Oxide Platelets: Effect of Increasing Laser Energy on Depth Penetration and Resulting Catalytic Activity

, Authors: Dana Schellenburg, Thomas Bihnam, Carsten Placke-Yan, Dylan Jennings, Takuma Sato, Dongsheng Zhang, Oleg Prymak, Milen Nachev, Bernd Sures, Kapil Dhaka, Ulrich Hagemann, Markus Heidelmann, Christian Liebscher, Alexander Schnegg, Kai Exner, Stephan Schulz, Martin Muhler, Stephan Barcikowski, Sven Reichenberger
Version undefined posted 03 November 2025
Posted
Nov 03, 2025
10.26434/chemrxiv-2025-nfjkc
 
Subject: Chemistry
,
Working Paper
, Title:

The Effect of Exogenous Acid Identity on Iron Tetraphenylporphyrin‐Catalyzed CO2 Reduction

, Authors: Kaeden Teindl, Eva Nichols
Version undefined posted 03 November 2025
Posted
Nov 03, 2025
10.26434/chemrxiv-2025-n2h1q
 
Subject: Chemistry
,
Working Paper
, Title:

‘‘Antenna-Like’ Light-Harvesting in Partially Metalated Porphyrin Hydrogen-bonded Organic Frameworks

, Authors: Alice Li, Subhadip Goswami, Richard Schaller, Joseph Hupp
Version undefined posted 03 November 2025
Posted
Nov 03, 2025
10.26434/chemrxiv-2025-27vwj
 
Subject: Chemistry
,
Working Paper
, Title:

Phase-Change Solvents for Thermally Switchable Ion Conduction in Organogels

, Authors: Yi-ming Yuan, Thomas Schroeder
Version undefined posted 03 November 2025
Posted
Nov 03, 2025
10.26434/chemrxiv-2025-mtvrc
 
Subject: Chemistry
,
Working Paper
, Title:

Copolymers of NVAm and NVP for efficient gene delivery

, Authors: Tom Fielitz, Christopher Raab, Vitalii Tkachenko, Kristine Maria Oleszkiewicz, Hendrik Fuchs, Matthias Hartlieb
Version undefined posted 03 November 2025
Posted
Nov 03, 2025
10.26434/chemrxiv-2025-jf0n4
 
Subject: Chemistry
,
Working Paper
, Title:

Dynamic Mechanochemical Memory for Imaging Stress History and Heterogeneity in Elastomers

, Authors: Anuj Joshi, Siddhant Kumar, Georgy Filonenko
Version undefined posted 03 November 2025
Posted
Nov 03, 2025
10.26434/chemrxiv-2025-s52s7
 
Subject: Chemistry
,
Working Paper
, Title:

Multiscale Simulation of Colorimetric Response of Silver Nanoparticles to Lead Ion Adsorption and Aggregation

, Authors: Aarav Garg
Version undefined posted 03 November 2025
Posted
Nov 03, 2025
10.26434/chemrxiv-2025-3s48x
 
Subject: Chemistry
,
Working Paper
, Title:

Functionalized anti -cryptophane-A as a platform for Type II porous ionic liquids

, Authors: Cintia Corrêa, Frederik Philippi, Thierry Brotin, Patrick Berthault, Sebastian Alberti, Sophie Fourmentin, Margarida Costa Gomes
Version undefined posted 03 November 2025
Posted
Nov 03, 2025
10.26434/chemrxiv-2025-fhfbr-v2
 
Subject: Chemistry
,
Working Paper
, Title:

Artificial Intelligence for Direct Prediction of Molecular Dynamics Across Chemical Space

, Authors: Fuchun Ge, Pavlo O. Dral
Version undefined posted 03 November 2025
Posted
Nov 03, 2025
10.26434/chemrxiv-2025-kc7sn-v2
 
Subject: Chemistry
,
Working Paper
, Title:

Development and Applications of Heterogeneous Chiral Bifunctional Alkaloid-Thioureas as Recyclable Brønsted Base Organocatalysts

, Authors: Ainara Pellicer, Xabier del Corte, Nora Aranburu, Javier Vicario, Patrick Toullec, Aitor Maestro
Version undefined posted 03 November 2025
Posted
Nov 03, 2025
10.26434/chemrxiv-2025-nl9b9-v2
 
Subject: Chemistry
,
Working Paper
, Title:

Experimentally derived charge density of halogen bonds to heavy pnictogens: revealing electronic structure and validating DFT approaches

, Authors: Lavanya Kumar, Sibananda G. Dash, Maura Malinska, Dominik Cinčić, Mihails Arhangelskis
Version undefined posted 03 November 2025
Posted
Nov 03, 2025
10.26434/chemrxiv-2025-l1n8q-v2
 
Subject: Chemistry
,
Working Paper
, Title:

Cosolvents Disrupt Water H-bond Networks at Electrode Interfaces: a Surface-enhanced 2D IR Study

, Authors: Saptarsi Mondal, Kevin Chen, Carlos Baiz
Version undefined posted 03 November 2025
Posted
Nov 03, 2025
10.26434/chemrxiv-2025-4jhpf-v2
 
Subject: Chemistry
,
Working Paper
, Title:

Total synthesis of the spirocyclic bis-indole alkaloid (-)-owerreine via a [4+2] annulation.

, Authors: Elisa Coll, Cyrille Kouklovsky, Laurent Evanno, Guillaume Vincent
Version undefined posted 03 November 2025
Posted
Nov 03, 2025
10.26434/chemrxiv-2025-2ctht-v2
 
Subject: Chemistry
,
Working Paper
, Title:

Identifying Dynamic Metal–Ligand Coordination Modes with Ensemble Learning

, Authors: Jacob Toney, Roland St. Michel, Aaron Garrison, Ilia Kevlishvili, Heather Kulik
Version undefined posted 03 November 2025
Posted
Nov 03, 2025
10.26434/chemrxiv-2025-7t9st-v2
 
Subject: Chemistry
,
Working Paper
, Title:

Speciation, Structural Refinement, and Distribution of Ti Sites in Titanium Silicalite‐1 from 47/49Ti NMR Crystallography at 28.2 Tesla

, Authors: Christoph Kaul, Jonas Koppe, Lukas Lätsch, Michael Wörle, Sadig Aghazada, Jacob Holmes, Christina Wartmann, Mingji Zheng, Albrecht Berkessel, Trees De Baerdemaeker, Andrei-Nicolae Parvulescu, Karsten Seidel, J. Henrique Teles, Alexander Yakimov, Christophe Copéret
Version undefined posted 03 November 2025
Posted
Nov 03, 2025
10.26434/chemrxiv-2025-c765h-v2
 
Subject: Chemistry
,
Working Paper
, Title:

From Polymorphs to Cocrystals and Salts: Successfully Predicting Axitinib's Challenging Crystal Forms

, Authors: Gregory Beran
Version undefined posted 03 November 2025
Posted
Nov 03, 2025
10.26434/chemrxiv-2025-67z8b-v2
 
Subject: Chemistry
,
Review
, Title:

KnowMat: An Agentic Approach to Transforming Unstructured Material Science Literature into Structured Data

, Authors: Hasan Muhammad Sayeed, Casey Clark, Trupti Mohanty, Taylor Sparks
Version undefined posted 03 November 2025
Posted
Nov 03, 2025
10.26434/chemrxiv-2025-l296q-v2
 
Subject: Chemistry
,
Working Paper
, Title:

Programmable DNA order/disorder modulates phase behavior and dynamics of DNA/peptide condensates

, Authors: Itai Katzir, Yanbing Wen, Inbal Razi, Vadim Skoi, Roy Beck, Hao Dong, Ayala Lampel
Version undefined posted 03 November 2025
Posted
Nov 03, 2025
10.26434/chemrxiv-2025-rjndg-v3
 
Subject: Chemistry
,
Working Paper
, Title:

The Chemical Bond in the Di-Atomics, HX, where X = F,O,N,C,B,Be: Orbital Exchange Calculations

, Authors: Paul Merrithew
Version undefined posted 03 November 2025
Posted
Nov 03, 2025
10.26434/chemrxiv-2023-c13md-v3
 
Subject: Chemistry
,
Working Paper
, Title:

From Crystal Structure Prediction to Polymorphic Behaviour: Monte Carlo Threshold Mapping of Crystal Energy Landscapes

, Authors: Pedro Juan-Royo, Graeme Day
Version undefined posted 03 November 2025
Posted
Nov 03, 2025
10.26434/chemrxiv-2025-mx2tl-v2
 
Subject: Chemistry
,
Working Paper
, Title:

Automated Flow Synthesis of Combinatorial Protein Libraries

, Authors: Corey Johnson, Dimuthu A. Vithanage, Gha Young Lee, Bradley L. Pentelute, John S. Albin
Version undefined posted 03 November 2025
Posted
Nov 03, 2025
10.26434/chemrxiv-2025-mn6ct-v2
 
Subject: Chemistry
,
Working Paper
, Title:

CrysText: A Generative AI Approach for Text-Conditioned Crystal Structure Generation using LLM

, Authors: Trupti Mohanty, Maitrey Mehta, Hasan M. Sayeed, Bat_El Oded, Itay Pitussi, Arie Borenstein, Vivek Srikumar, Taylor D. Sparks
Version undefined posted 03 November 2025
Posted
Nov 03, 2025
10.26434/chemrxiv-2024-gjhpq-v2
 
Subject: Chemistry
,
Working Paper
, Title:

Guiding the down-selection of hydrogen storage technologies in the context of backup power systems

, Authors: Syed Saqline, Fabian Rosner, Xinyi Wang, Jocelyn Shyong, Peng Peng, Mark Allendorf, Thomas Gennett, Tom Autrey, Mark Bowden, Hanna Breunig
Version undefined posted 03 November 2025
Posted
Nov 03, 2025
10.26434/chemrxiv-2025-xn1gk
 
Subject: Chemistry
,
Working Paper
, Title:

Metal-Chelated Hybrid Dimeric Acyclic Phosphazanes: Tunable and Robust Platforms for High-Affinity Anion Binding

, Authors: Gavin Hum, Isabel Si Jia Phang, Ong How Chee, Yongxin Li, Felix Leon, Zheng Jie Glenn Ng, Jack K. Clegg, Felipe Garcia
Version undefined posted 03 November 2025
Posted
Nov 03, 2025
10.26434/chemrxiv-2025-7w4dv
 
Subject: Chemistry
,
Working Paper
, Title:

The influence of chemical structure on the electronic structure of propylene oxide

, Authors: David Matalon, Kate Nixon, Darryl Jones
Version undefined posted 03 November 2025
Posted
Nov 03, 2025
10.26434/chemrxiv-2025-ld3v2
 
Subject: Chemistry
,
Working Paper
, Title:

Breaking the Loop: Sequestering Perfluorinated Acids from the Urban Water Cycle via Selective Resin Regeneration

, Authors: Matteo Tagliavini, Zhouyao Wang, Shane Allen Snyder, Darren Delai Sun
Version undefined posted 03 November 2025
Posted
Nov 03, 2025
10.26434/chemrxiv-2025-q5xwr
 
Subject: Chemistry
,
Working Paper
, Title:

Cooling water to near freezing breaks the activity-stability trade-off of water oxidation catalyzed by manganese oxides

, Authors: Aufandra Cakra Wardhana, Hideshi Ooka, Ailong Li, Kiyohiro Adachi, Chen Chen, Daisuke Hashizume, Ryuhei Nakamura
Version undefined posted 03 November 2025
Posted
Nov 03, 2025
10.26434/chemrxiv-2025-99mx9
 
Subject: Chemistry
,
Working Paper
, Title:

Analyzing atmospheric CO2 time-series data using a growth model

, Authors: Shruti S, Vijay Prakash S
Version undefined posted 03 November 2025
Posted
Nov 03, 2025
10.26434/chemrxiv-2025-lr5r0
 
Subject: Chemistry
,
Working Paper
, Title:

A Multi-scale Modelling Strategy to Evaluate Permeability in Diagnostic Paper Membranes

, Authors: Anna Anandita, Gaytri Sachdeva, Kundan Kumar, Dharitri Rath
Version undefined posted 03 November 2025
Posted
Nov 03, 2025
10.26434/chemrxiv-2025-5rgrc
 
Subject: Chemistry
,
Review
, Title:

Electrocatalytic Strategies for Sustainable Manufacturing: A Critical Review of CO₂ and H₂O₂ Production

, Authors: Ikenna Okechukwu, Chinwendu Faustina Achilonu, Nkiruka Nancy Duru, Samson Uchenna Eze, Rebecca Chioma Okereke, Nneoma Anne Ezealuma, Oluwafemi Fikayomi Bamidele, Odinakachukwu Nwaehiri
Version undefined posted 03 November 2025
Posted
Nov 03, 2025
10.26434/chemrxiv-2025-8st0j
 
Subject: Chemistry
,
Working Paper
, Title:

Mixed Gaussian and plane wave basis set implementation of the random phase approximation and of σ-functionals within the program package CP2K

, Authors: Raviraj Mandalia, Egor Trushin, Frederick Stein, Thomas Kühne, Andreas Görling
Version undefined posted 03 November 2025
Posted
Nov 03, 2025
10.26434/chemrxiv-2025-rr6p3
 
Subject: Politics and International Relations
,
Working Paper
, Title:

AI World Order: How Artificial Intelligence is Reshaping Global Authority and Legitimacy

, Authors: Rishik Dev
Version undefined posted 03 November 2025
Posted
Nov 03, 2025
10.33774/apsa-2025-30cfd
 
Subject: Chemistry
,
Working Paper
, Title:

Acoustic Droplet Ejection High Resolution Mass Spectrometry Enables High-Throughput Analysis of Proteins in Complex Biologic and Vaccine Matrices

, Authors: Jarrod Laro, Rodell Barrientos, Eli Larson, Erik Regalado, Emmanuel Appiah-Amponsah, Chang Liu, Joseph Gouker, Devin Makey, Hang Hu, Ophelia Ukaegbu
Version undefined posted 03 November 2025
Posted
Nov 03, 2025
10.26434/chemrxiv-2025-0rz39
 
Subject: Chemistry
,
Working Paper
, Title:

Assessing Compost Carbon Permanence with Solid-State 13C NMR: Advancing Standards for Climate and Carbon Markets

, Authors: Kathryn Phung, Bezaye Tessema, Xiaodong Gao, Melinda Gonzales, Asmeret Berhe, Rebecca Ryals, Whendee Silver, Tibisay Perez, Caroline Masiello
Version undefined posted 03 November 2025
Posted
Nov 03, 2025
10.26434/chemrxiv-2025-1lttb
 
Subject: Chemistry
,
Working Paper
, Title:

Assembly of a Small-Ion Coordination-Polymer Superlattice

, Authors: Shubasis Roy, Chandan Kumar Tiwari, Olga Iliashevsky, Jintumol Mathew, Mark Baranov, Nitai Leffler, Petr Kral, Ira Alan Weinstock
Version undefined posted 03 November 2025
Posted
Nov 03, 2025
10.26434/chemrxiv-2025-4q9wp
 
Subject: Chemistry
,
Working Paper
, Title:

Sulfidation doses of nanoscale zerovalent iron particles need to be tuned to achieve high reactivity to different chlorinated solvent compounds

, Authors: Siyuan Mu, Yanyan Zhang, Subhasis Ghoshal
Version undefined posted 03 November 2025
Posted
Nov 03, 2025
10.26434/chemrxiv-2025-pzj1t
 
Subject: Economics
,
Working Paper
, Title:

The Democratisation of Energy Modelling

, Authors: Mark Howells
Version undefined posted 03 November 2025
Posted
Nov 03, 2025
10.33774/coe-2025-25b06
 
Subject: Chemistry
,
Working Paper
, Title:

Modular Design enables rational access to π-Complexes of elusive Phosphacyclic Biradicaloids

, Authors: Stefan Frei, Michael Neuwirt, Peter Coburger
Version undefined posted 03 November 2025
Posted
Nov 03, 2025
10.26434/chemrxiv-2025-24ltl
 
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