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  • Currently displaying 3601 - 3620 of 31095 publications
Author(s)
Publication title
Journal Name
Publication year
Basis Set Limit CCSD(T) Energies for Extended Molecules via a Reduced-Cost Explicitly Correlated Approach.
M Kállay, RA Horváth, L Gyevi-Nagy, PR Nagy
Journal of Chemical Theory and Computation
(2022)
19
Allosteric and Electrostatic Cooperativity in a Heteroditopic Halogen Bonding Receptor System.
AJ Taylor, A Docker, PD Beer
Chemistry – An Asian Journal
(2022)
18
Quantitative Singlet Fission in Solution-Processable Dithienohexatrienes.
KJ Fallon, N Sawhney, DTW Toolan, A Sharma, W Zeng, S Montanaro, A Leventis, S Dowland, O Millington, D Congrave, A Bond, R Friend, A Rao, H Bronstein
Journal of the American Chemical Society
(2022)
144
A Solid State NMR Investigation of Poly (ADP-ribose) and Its Involvement in Tissue Calcification
A Murgoci
(2022)
A Kinetic Map of the Influence of Biomimetic Lipid Model Membranes on Aβ42 Aggregation.
KN Baumann, G Šneiderienė, M Sanguanini, M Schneider, O Rimon, A González Díaz, H Greer, D Thacker, S Linse, TPJ Knowles, M Vendruscolo
ACS Chem Neurosci
(2022)
14
Principles of assembly and regulation of condensates of Polycomb repressive complex 1 through phase separation
K Brown, PY Chew, S Ingersoll, JR Espinosa, A Aguirre, T Kutateladze, RC Guevara, X Ren
(2022)
Anion-polarisation-directed short-range-order in antiperovskite Li$_2$FeSO
SW Coles, V Falkowski, HS Geddes, GE Pérez, SG Booth, AG Squires, C O'Rourke, K McColl, AL Goodwin, SA Cussen, SJ Clarke, MS Islam, BJ Morgan
(2022)
Interplay of static and dynamic disorder in the mixed-metal chalcohalide Sn₂SbS₂I₃
A Nicolson, J Breternitz, SR Kavanagh, Y Tomm, K Morita, AG Squires, M Tovar, A Walsh, S Schorr, DO Scanlon
(2022)
Recent Advances in MXene-Based Aerogels: Fabrication, Performance and Application
C Wei, Q Zhang, Z Wang, W Yang, H Lu, Z Huang, W Yang, J Zhu
Advanced Functional Materials
(2022)
33
Plasmonic Sensing Assay for Long-Term Monitoring (PSALM) of Neurotransmitters in Urine.
W-H Chen, W Wang, Q Lin, D-B Grys, M Niihori, J Huang, S Hu, B de Nijs, OA Scherman, JJ Baumberg
ACS Nanosci Au
(2022)
3
Interplay of static and dynamic disorder in the mixed-metal chalcohalide Sn₂SbS₂I₃
A Nicolson, J Breternitz, SR Kavanagh, Y Tomm, K Morita, AG Squires, M Tovar, A Walsh, S Schorr, DO Scanlon
(2022)
Crystal structures and fragment screening of SARS-CoV-2 NSP14 reveal details of exoribonuclease activation and mRNA capping and provide starting points for antiviral drug development.
N Imprachim, Y Yosaatmadja, JA Newman
Nucleic acids research
(2022)
51
Enantioselective fullerene functionalization through stereochemical information transfer from a self-assembled cage
Z Lu, TK Ronson, AW Heard, S Feldmann, N Vanthuyne, A Martinez, JR Nitschke
Nature chemistry
(2022)
15
Clay hydroxyl isotopes show an enhanced hydrologic cycle during the Paleocene-Eocene Thermal Maximum
GL Walters, SJ Kemp, JD Hemingway, DT Johnston, DA Hodell
Nature Communications
(2022)
13
Identifying Patterns and Sources of Fine and Ultrafine Particulate Matter in London Using Mobile Measurements of Lung-Deposited Surface Area
RU Shah, LE Padilla, DR Peters, M Dupuy-Todd, ER Fonseca, GQ Ma, OAM Popoola, RL Jones, J Mills, NA Martin, RA Alvarez
Environ Sci Technol
(2022)
57
Genetically programmed cell-based synthesis of non-natural peptide and depsipeptide macrocycles
M Spinck, C Piedrafita, WE Robertson, TS Elliott, D Cervettini, D de la Torre, JW Chin
Nat Chem
(2022)
15
Perphenazine-Macrocycle Conjugates Rapidly Sequester the Aβ42 Monomer and Prevent Formation of Toxic Oligomers and Amyloid
SR Ball, JSP Adamson, MA Sullivan, MR Zimmermann, V Lo, M Sanz-Hernandez, X Jiang, AH Kwan, ADJ McKenzie, EL Werry, TPJ Knowles, M Kassiou, G Meisl, MH Todd, PJ Rutledge, M Sunde
ACS Chem Neurosci
(2022)
14
Biomolecular condensate phase diagrams with a combinatorial microdroplet platform
WE Arter, R Qi, NA Erkamp, G Krainer, K Didi, TJ Welsh, J Acker, J Nixon-Abell, S Qamar, J Guillén-Boixet, TM Franzmann, D Kuster, AA Hyman, A Borodavka, PS George-Hyslop, S Alberti, TPJ Knowles
Nat Commun
(2022)
13
A rod- and tessellation-based comparative analysis of polymorphic and structurally-invariant molecular crystals: application to sulfathiazole and 2-benzyl-5-benzylidenecyclopentanones.
NW Thomas, DS Hughes
Acta crystallographica Section B, Structural science, crystal engineering and materials
(2022)
79
To thread or not to thread? Effective potentials and threading interactions between asymmetric ring polymers.
R Staňo, CN Likos, J Smrek
Soft Matter
(2022)
19