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  • Currently displaying 2621 - 2640 of 30196 publications
Author(s)
Publication title
Journal Name
Publication year
Conformational changes in protein kinase A along its activation cycle are rooted in the folding energetics of cyclic-nucleotide binding domains
AK Chau, K Bracken, L Bai, D Pham, LL Good, RA Maillard
Journal of Biological Chemistry
(2023)
299
TREXIO: A file format and library for quantum chemistry.
E Posenitskiy, VG Chilkuri, A Ammar, M Hapka, K Pernal, R Shinde, EJ Landinez Borda, C Filippi, K Nakano, O Kohulák, S Sorella, P de Oliveira Castro, W Jalby, PL Ríos, A Alavi, A Scemama
The Journal of Chemical Physics
(2023)
158
Design and Frabication of Optical Li+ Sensors for Application in Li-ion Batteries
H Francis
(2023)
Finding Excited-State Minimum Energy Crossing Points on a Budget: Non-Self-Consistent Tight-Binding Methods.
P Pracht, C Bannwarth
J Phys Chem Lett
(2023)
14
A Hybrid-DFT Study of Intrinsic Point Defects in $MX_2$ ($M$=Mo, W; $X$=S, Se) Monolayers
A Akkoush, Y Litman, M Rossi
(2023)
Excited States, Symmetry Breaking, and Unphysical Solutions in State-Specific CASSCF Theory
A Marie, HGA Burton
The journal of physical chemistry. A
(2023)
127
A Photoredox Reaction for the Selective Modification of 5-Carboxycytosine in DNA.
BJ Mortishire-Smith, SM Becker, A Simeone, L Melidis, S Balasubramanian
Journal of the American Chemical Society
(2023)
145
Aza-Cibalackrot: Turning on Singlet Fission Through Crystal Engineering.
M Purdy, JR Walton, KJ Fallon, DTW Toolan, P Budden, W Zeng, MK Corpinot, D-K Bučar, L van Turnhout, R Friend, A Rao, H Bronstein
Journal of the American Chemical Society
(2023)
145
Expanding Transition Metal-Mediated Bioorthogonal Decaging to Include C-C Bond Cleavage Reactions
GM Dal Forno, E Latocheski, A Beatriz Machado, J Becher, L Dunsmore, AL St John, BL Oliveira, CD Navo, G Jiménez-Osés, R Fior, JB Domingos, GJL Bernardes
J Am Chem Soc
(2023)
145
High-density volumetric super-resolution microscopy
S Daly, JF Fernandes, E Bruggeman, A Handa, R Peters, S Benaissa, B Zhang, JS Beckwith, EW Sanders, RR Sims, D Klenerman, SJ Davis, K O’Holleran, SF Lee
(2023)
Glucagon-like peptide 1 aggregates into low-molecular-weight oligomers off-pathway to fibrillation
E Přáda Brichtová, M Krupová, P Bouř, V Lindo, A Gomes Dos Santos, SE Jackson
Biophys J
(2023)
122
Trapping of Photoluminescent Kinetic Intermediates During High-Concentration Synthesis of Non-Emissive Metal-Organic Frameworks
A Halder, D Bain, T Pitt, Z Shi, J Oktawiec, J-H Lee, S Tsangari, M Ng, J Fuentes-Rivera, A Forse, T Runcevski, D Muller, A Musser, P Milner
(2023)
Diffusion-assisted displacive transformation in Yttrium-doped Sb2Te3 phase change materials
K Li, B Liu, J Zhou, SR Elliott, Z Sun
Acta Materialia
(2023)
249
Early detection of COPD patients' symptoms with personal environmental sensors: a remote sensing framework using probabilistic latent component analysis with linear dynamic systems
Ş Kolozali, L Chatzidiakou, R Jones, JK Quint, F Kelly, B Barratt
Neural Computing and Applications
(2023)
35
Characterisation of neurodegenerative diseases derived protein aggregates using improved single-molecule pull-down
Y Zhang
(2023)
AbNatiV: VQ-VAE-based assessment of antibody and nanobody nativeness for hit selection, humanisation, and engineering
A Ramon, M Ali, M Atkinson, A Saturnino, K Didi, C Visentin, S Ricagno, X Xu, M Greenig, P Sormanni
(2023)
The Structural Stability Limit of Layered Lithium Transition Metal Oxides Due to Oxygen Release at High State of Charge and Its Dependence on the Nickel Content
S Oswald, HA Gasteiger
Journal of the Electrochemical Society
(2023)
170
The Intermetallic Reactivity Database: Compiling Chemical Pressure and Electronic Metrics toward Materials Design and Discovery
JS Van Buskirk, JD Kraus, DC Fredrickson
Chemistry of Materials
(2023)
35
Secondary Bracing Ligands Drive Heteroleptic Cuboctahedral PdII 12 Cage Formation
CF Espinosa, TK Ronson, JR Nitschke
J Am Chem Soc
(2023)
145
Surfaces for Study of Receptor Dynamics on T Cells.
J McColl, D Klenerman
Methods Mol Biol
(2023)
2654