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  • Currently displaying 1901 - 1920 of 30212 publications
Author(s)
Publication title
Journal Name
Publication year
The Development and Application of Ultra-sensitive Protein Aggregate Detection Techniques
Z Xia
(2024)
Equivariant Matrix Function Neural Networks
I Batatia, LL Schaaf, H Chen, G Csányi, C Ortner, FA Faber
(2024)
Transient interactions between the fuzzy coat and the cross-β core of brain-derived Aβ42 filaments
M Vendruscolo, M Milanesi, ZF Brotzakis
(2024)
Rationale for the Extrapolation Procedure in Selected Configuration Interaction
HGA Burton, P-F Loos
(2024)
Materials for stable metal-oxygen battery cathodes: general discussion
GA Attard, EJ Calvo, LA Curtiss, D Dewar, JHJ Ellison, X Gao, CP Grey, LJ Hardwick, G Horwitz, J Janek, LR Johnson, JW Jordan, S Matsuda, S Mondal, AR Neale, N Ortiz-Vitoriano, I Temprano, G Vailaya, ED Wachsman, H-H Wang, Y Wu, S Ye
Faraday discussions
(2024)
248
Solvent-dependent iodide interactions in LiO2 electrolytes - a molecular dynamics study.
E Jónsson, AH Berge, CP Grey, I Temprano
Faraday Discussions
(2024)
248
Towards practical metal–oxygen batteries: general discussion
LA Archer, PG Bruce, EJ Calvo, D Dewar, JHJ Ellison, SA Freunberger, X Gao, LJ Hardwick, G Horwitz, J Janek, LR Johnson, JW Jordan, S Matsuda, S Menkin, S Mondal, Q Qiu, T Samarakoon, I Temprano, K Uosaki, G Vailaya, ED Wachsman, Y Wu, S Ye
Faraday Discussions
(2024)
248
Engineering Considerations for Practical Lithium-air Electrolytes
JHJ Ellison, CP Grey
Faraday Discussions
(2024)
248
Mechanism of ORR and OER in non-aqueous electrolytes: general discussion
GA Attard, PG Bruce, EJ Calvo, Y Chen, LA Curtiss, D Dewar, JHJ Ellison, J Fernández-Vidal, SA Freunberger, X Gao, CP Grey, LJ Hardwick, G Horwitz, J Janek, LR Johnson, E Jónsson, S Karunarathne, S Matsuda, S Menkin, S Mondal, S Nakanishi, N Ortiz-Vitoriano, Z Peng, JP Rivera, I Temprano, K Uosaki, ED Wachsman, Y Wu, S Ye
Faraday Discussions
(2024)
248
Input and output files supporting Extension, Development and Evaluation of the representation of the OH-initiated DMS oxidation mechanism in the MCM v3.3.1 framework
L Jacob, C Giorio, A Archibald
(2024)
Synthesis and Structure-Activity Relationship Studies of Dioxane- and Oxathiane-Based Analogs of (–)-Zampanolide
E Cotter, S Glauser, A Lelke, P Scapozza, S Berardozzi, D Lucena-Agell, R Hortigüela, M Oliva, JF Díaz, K-H Altmann
(2024)
Establishing a synthetic orthogonal replication system enables accelerated evolution in E. coli
R Tian, FBH Rehm, D Czernecki, Y Gu, JF Zürcher, KC Liu, JW Chin
Science
(2024)
383
Improving Antibody Humanness Prediction using Patent Data
T Ucar, A Ramon, D Oglic, R Croasdale-Wood, T Diethe, P Sormanni
(2024)
Towards unravelling the mechanism and function of exoelectrogenesis in cyanobacteria
E Wroe
(2024)
Basis set limit MP2 energies for extended molecules via a reduced-cost explicitly correlated approach
RA Horváth, M Kállay
Molecular Physics
(2024)
122
Ten-electron count rule for the binding of adsorbates on single-atom alloy catalysts
J Schumann, M Stamatakis, A Michaelides, R Réocreux
Nature Chemistry
(2024)
16
Cation-ordering in low-temperature niobium-rich NbWO bronzes: New anodes for high rate Li-ion batteries
C Grey, S Nagendran, A Mahadevegowda, S Vema, M Danaie, W Song, B Wen, C Ducati
(2024)
Thermochemical Valorization of Waste Plastic for Production of Synthetic Fuels, Fine Chemicals, and Carbon Nanotubes
KY Tang, CY Chan, CHT Chai, BQL Low, ZY Toh, BWL Wong, JZX Heng, Z Li, C-LK Lee, XJ Loh, C-H Wang, E Ye
ACS Sustainable Chemistry & Engineering
(2024)
12
Using Generative Modeling to Endow with Potency Initially Inert Compounds with Good Bioavailability and Low Toxicity
RI Horne, J Wilson-Godber, A González Díaz, ZF Brotzakis, S Seal, RC Gregory, A Possenti, S Chia, M Vendruscolo
Journal of chemical information and modeling
(2024)
64
Machine-learning structural reconstructions for accelerated point defect calculations
I Mosquera-Lois, SR Kavanagh, AM Ganose, A Walsh
(2024)