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  • Currently displaying 1941 - 1960 of 29918 publications
Author(s)
Publication title
Journal Name
Publication year
CONFPASS: fast DFT re-optimizations of structures from conformation searches
CC Lam, JM Goodman
Journal of chemical information and modeling
(2023)
63
Tricritical Behavior in Dynamical Phase Transitions.
T Agranov, ME Cates, RL Jack
Physical Review Letters
(2023)
131
xTC: An efficient treatment of three-body interactions in transcorrelated methods
EM Christlmaier, T Schraivogel, P López Ríos, A Alavi, D Kats
The Journal of chemical physics
(2023)
159
Asymmetric Synthesis of Chiral‐at‐P Alkenylphosphonamidates through Nickel‐Catalyzed C−P Coupling of Phosphoramidites and Alkenyl Halides
X-B Chen, D Padín, CN Stindt, BL Feringa
Angewandte Chemie (International ed. in English)
(2023)
62
Application of variational graph encoders as an effective generalist algorithm in computer-aided drug design
HYI Lam, R Pincket, H Han, XE Ong, Z Wang, J Hinks, Y Wei, W Li, L Zheng, Y Mu
Nature Machine Intelligence
(2023)
5
Asymmetric Synthesis of Chiral‐at‐P Alkenylphosphonamidates through Nickel‐Catalyzed C−P Coupling of Phosphoramidites and Alkenyl Halides
X Chen, D Padín, CN Stindt, BL Feringa
Angewandte Chemie
(2023)
135
Radiative Forcing From the 2014-2022 Volcanic and Wildfire Injections
P Yu, RW Portmann, Y Peng, C Liu, Y Zhu, E Asher, Z Bai, Y Lu, J Bian, M Mills, A Schmidt, KH Rosenlof, OB Toon
Geophysical Research Letters
(2023)
50
Discovery and Development of the Enantioselective Minisci Reaction.
PD Bacoş, ASK Lahdenperä, RJ Phipps
Accounts of Chemical Research
(2023)
56
Towards Photoredox-Cleavable Prodrugs
J Mandrup Kandemir
(2023)
Aromatic and arginine content drives multiphasic condensation of protein-RNA mixtures
PY Chew, JA Joseph, R Collepardo-Guevara, A Reinhardt
Biophysical Journal
(2023)
123
Investigations on the Synthesis of Cyclodiphosphazane-based Linear Oligomers and Hybrid Macrocycles
A Terzopoulos
(2023)
Self-replication of Aβ42aggregates occurs on small and isolated fibril sites
S Curk, J Krausser, G Meisl, D Frenkel, S Linse, TCT Michaels, TPJ Knowles, A Šarić
(2023)
Stratospheric water vapor affecting atmospheric circulation
E Charlesworth, F Plöger, T Birner, R Baikhadzhaev, M Abalos, NL Abraham, H Akiyoshi, S Bekki, F Dennison, P Jöckel, J Keeble, D Kinnison, O Morgenstern, D Plummer, E Rozanov, S Strode, G Zeng, T Egorova, M Riese
Nature Communications
(2023)
14
Cu-releasing nanoparticles induce the catalytic transamination of amino acids and GSSG under tumor microenvironment conditions
J Bonet-Aleta, JV Alegre-Requena, J Martin-Martin, M Encinas-Gimenez, A Martin-Pardillos, P Martin-Duque, JL Hueso, J Santamaria
(2023)
Phase separation and molecular ordering of the prion-like domain of the Arabidopsis thermosensory protein EARLY FLOWERING 3
S Hutin, JR Kumita, VI Strotmann, A Dolata, WL Ling, N Louafi, A Popov, P-E Milhiet, M Blackledge, MH Nanao, PA Wigge, Y Stahl, L Costa, MD Tully, C Zubieta
Proc Natl Acad Sci U S A
(2023)
120
Impact of Temperature, High Pressure and High Shear on Adsorbed Molecular Layers
N Sharifi
(2023)
A Hybrid‐Density Functional Theory Study of Intrinsic Point Defects in MX2 (M = Mo, W; X = S, Se) Monolayers
A Akkoush, Y Litman, M Rossi
physica status solidi (a) – applications and materials science
(2023)
221
Non-Covalent Interactions in Water Using Synthetic and Biological Receptors
G Tobajas Curiel
(2023)
Ligands as Structural Probes for Amyloid Fibrils
TS Chisholm
(2023)
Super-resolution imaging unveils the self-replication of tau aggregates upon seeding.
E Dimou, T Katsinelos, G Meisl, BJ Tuck, S Keeling, AE Smith, E Hidari, JYL Lam, M Burke, S Lövestam, RT Ranasinghe, WA McEwan, D Klenerman
Cell Rep
(2023)
42