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  • Currently displaying 21 - 40 of 30054 publications
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Journal Name
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Bulk hexagonal diamond
S Lai, X Yang, J Shi, S Liu, Y Guo, L Yan, J Zang, Z Zhang, Q Jia, J Sun, S Cheng, C Shan
Nature
(2026)
The second Gibbs paradox
D Frenkel
The Journal of Chemical Physics
(2026)
164
False Metallization in Short-Ranged Machine Learned Interatomic Potentials
IJ Parker, MJ Hoffmann, WJ Baldwin, S Han, S Gupta, KD Fong, A Michaelides, C Schran, S De, G Csányi
(2026)
Chemical Softness as a Predictor for Reactivity at Metal Surfaces
AL Gunton, SJ Jenkins
Phys Chem Chem Phys
(2026)
Structural Plausibility Without Binding Specificity: Limits of AI-Based Antibody-Antigen Structure Prediction Confidence Scores
E Smorodina, M Ali, K Kropivšek Brumat, L Salicari, S Miklavc, A Kappassov, C Fu, P Sormanni, A de Marco, V Greiff
(2026)
Charge-triggered switching mechanism in selenium selector enabling ultralow leakage current.
Y Sun, T Gotoh, J Zhao, M Zhang, S Shi, H Zhang, Z Liu, J Shen, R Dronskowski, Z Song, SR Elliott, M Zhu
Nat Mater
(2026)
Atomistic Origin of Photoluminescence Quenching in Colloidal MoS2 and WS2 Nanoplatelets
S Kumar, M Fröhlich, S Velja, M Kögel, O Strolka, A Niebur, S Ginzburg, MS Ramzan, JC Meyer, J Lauth, C Cocchi
Nano Lett
(2026)
26
Dissecting the Binding Interactions of the Chromatin Remodeler SMARCA4 with G‑Quadruplex DNA
SK Madden, D Tannahill, S Balasubramanian
Biochemistry
(2026)
65
Emergent Polar Metal Phase in a Van der Waals Mott Magnet
S Deng, MJ Coak, CRS Haines, H Hamidov, GI Lampronti, DM Jarvis, X Zhang, C Liu, D Daisenberger, MR Warren, TC Hansen, S Klotz, C Kim, P Yang, B Wang, J Cheng, J-G Park, AR Wildes, SS Saxena
(2026)
A Computational Community Blind Challenge on Pan-Coronavirus Drug Discovery Data
H MacDermott-Opeskin, J Scheen, C Wognum, JT Horton, D West, AM Payne, MA Castellanos, S Colby, E Griffen, D Cousins, J Stacey, L Reid, JC Aschenbrenner, D Fearon, B Balcomb, P Marples, CWE Tomlinson, R Lithgo, AS Godoy, M Winokan, H Barr, N Lahav, M Lavi, S Duberstein, G Cohen, G Fate, B Lefker, R Robinson, T Szommer, N Lynch, DDL Minh, VNT La, L Kang, K Huddleston, R Renslow, M Tollefson, WP Walters, C Xu, J Hsu, J St-Laurent, H Etsmoberg, L Zhu, A Quirke, MI Abdul Haleem, I Alibay, G Baid, B Birnbaum, KP Bishop, H Bohorquez, A Bose, CJ Brown, J Burns, L Cai, R Cedeno, S de Cesco, V Chupakhin, F Clark, DJ Cole, C Corbi-Verge, M Danial, A Davi, W Dehaen, NP Doering, A Dougha, M-P Dréanic, B Eakin, A Ehrlich, R Elijosius, J Fülöp, A Gitter, K Goossens, Y Gu, T Head-Gordon, L Hoffer, J Hofmans, E Jiang, B Kaminow, S Khosravi, AF Khoualdi, EB Lenselink, Z Liu, Y Liu, S Liu, Y Ma, P Maher, I Mayer, O Mendez-Lucio, ASJS Mey, J Michel, F Montanari, T Niu, R Ogino, A Palaniappan, X Pan, A Patnaik, L-H Pham, L Pinto, J Purnomo, A Rich, L Schaaf, C Schran, RK Singh, M Srilakshmi, SP Srivastava, K Sun, Z Sun, V Talagayev, B Thirukonda Subramanian Balakrishnan, I Titus, A Tkatchenko, W Treyde, G Tricarico, A Tripp, N Vithayapalert, Y Wang, AT Wasi, S Wedig, G Wolber, B Xu, W Zhou, F von Delft, A Lee, K Kirkegaard, P Sjö, JS Fraser, JD Chodera
Journal of chemical information and modeling
(2026)
Influence of Liquid on Crystallite Size Evolution During Ball Milling
ME Charlesworth, GI Lampronti, AM Belenguer, S Day, LK Saunders, ET Connolly, PA Midgley, AAL Michalchuk
Crystal Growth & Design
(2026)
Peptide cages: bioinspired supramolecular architectures for next-generation applications
S Adorinni, H Xu, JR Nitschke, S Marchesan
Chemical science
(2026)
CO2, N2 and H2 adsorption in Zn2+-containing zeolites and metal-organic frameworks.
PP Samal, F Berger, S Krishnamurty, J Sauer
Physical Chemistry Chemical Physics
(2026)
28
Triple threat bismuth peptide imaging in cells
S Voss, CJ Kidman, LD Adair, SO Nitschke, P Patawanich, T Koh, AT Baker, DL Howard, EJ New, HH Harris, C Nitsche
Chem Sci
(2026)
Condensate-Driven Transcriptional Reprogramming Defines Core Vulnerabilities in Esophageal and Gastric Cancers
L Alvarez-Carrion, AR Tejedor, JA Ardura, V Alonso, C Alonso-Moreno, R Collepardo-Guevara, I Gutierrez-Rojas, C Privat, V Moreno, E Calvo, B Gyorffy, JR Espinosa, A Ocana
(2026)
Highly mutagenic continuous evolution in E. coli using a Φ29-based orthogonal replication system
FBH Rehm, KC Liu, R Tian, JW Chin
Nature Biotechnology
(2026)
Electrostatic control of chromatin compaction safeguards against apoptotic DNA release
MFD Spicer, S Wijma, N Schütte, J Huertas, MJ Maristany, JI Pérez López, L Chen, M Alaabo, MK Rosen, R Collepardo-Guevara, DW Gerlich
(2026)
CyanOperon: an operon building expansion for the CyanoGate MoClo toolkit
MJ Astbury, AA Schiavon Osorio, AJ Victoria, AJ McCormick
(2026)
Living Photoanodes for Solar-Driven Water Oxidation.
RM Egan, AJ Victoria, JZ Zhang
Chem Rev
(2026)
126
Development of fully interactive hydrogen with methane in UKESM1.0
M Brown
Geoscientific Model Development
(2026)
19