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  • Currently displaying 2341 - 2360 of 29854 publications
Author(s)
Publication title
Journal Name
Publication year
Accurate Energy Barriers for Catalytic Reaction Pathways: An Automatic Training Protocol for Machine Learning Force Fields
L Schaaf, E Fako, S De, A Schäfer, G Csányi
(2023)
Chem-map: Profiling drug binding to chromatin in cells
Z Yu, J Spiegel, L Melidis, WWI Hui, X Zhang, A Radzevičius, S Balasubramanian
Nature Biotechnology
(2023)
41
Cooperative Initiation in a Dinuclear Indium Complex for CO2 Epoxide Copolymerization.
H-J Jung, K Nyamayaro, HA Baalbaki, C Goonesinghe, P Mehrkhodavandi
Inorganic Chemistry
(2023)
62
Disintegrate (DIN) Theory Enabling Precision Engineering of Proteins.
P Chauhan, R V, M Kumar, R Molla, U V B, V Rai
ACS Cent Sci
(2023)
9
Roadmap on chalcogenide photonics
B Gholipour, SR Elliott, MJ Müller, M Wuttig, DW Hewak, BE Hayden, Y Li, SS Jo, R Jaramillo, RE Simpson, J Tominaga, Y Cui, A Mandal, BJ Eggleton, M Rochette, M Rezaei, I Alamgir, HM Shamim, R Kormokar, A Anjum, GT Zeweldi, TS Karnik, J Hu, SO Kasap, G Belev, A Reznik
Journal of Physics: Photonics
(2023)
5
Soluble Diphenylhexatriene Dimers for Intramolecular Singlet Fission with High Triplet Energy
O Millington, S Montanaro, A Leventis, A Sharma, SA Dowland, N Sawhney, KJ Fallon, W Zeng, DG Congrave, AJ Musser, A Rao, H Bronstein
Journal of the American Chemical Society
(2023)
145
Molecular Dynamics with Chemical Accuracy─Alkane Adsorption in Acidic Zeolites
F Berger, M Rybicki, J Sauer
ACS Catalysis
(2023)
13
Excess mortality associated with high ozone exposure: A national cohort study in China
Y Yuan, K Wang, HZ Sun, Y Zhan, Z Yang, K Hu, Y Zhang
Environmental science and ecotechnology
(2023)
15
Multifaceted View on the Mechanism of a Photochemical Deracemization Reaction
RJ Kutta, J Großkopf, N van Staalduinen, A Seitz, P Pracht, S Breitenlechner, C Bannwarth, P Nuernberger, T Bach
J Am Chem Soc
(2023)
145
AlphaFold Prediction of Structural Ensembles of Disordered Proteins
ZF Brotzakis, S Zhang, M Vendruscolo
(2023)
Hybrid photocathode based on a Ni molecular catalyst and Sb2Se3 for solar H2 production
DA Garcia-Osorio, TP Shalvey, L Banerji, K Saeed, G Neri, LJ Phillips, OS Hutter, C Casadevall, D Antón-García, E Reisner, JD Major, AJ Cowan
Chemical communications (Cambridge, England)
(2023)
59
Bioprinting microporous functional living materials from protein-based core-shell microgels.
Y Ou, S Cao, Y Zhang, H Zhu, C Guo, W Yan, F Xin, W Dong, Y Zhang, M Narita, Z Yu, T Knowles
Nat Commun
(2023)
14
In situ Detection of Cobaloxime Intermediates During Photocatalysis Using Hollow-Core Photonic Crystal Fiber Microreactors
T Lawson, AS Gentleman, J Pinnell, A Eisenschmidt, D Antón-García, MH Frosz, E Reisner, TG Euser
Angewandte Chemie (International ed. in English)
(2023)
62
Spin-constrained Hartree-Fock and the generator coordinate method for the 2-site Hubbard model
S De Baerdemacker, A Ayati, HGA Burton, X De Vriendt, P Bultinck, G Acke
(2023)
Multistate Redox-Switchable Ion Transport Using Chalcogen-Bonding Anionophores.
A Docker, TG Johnson, H Kuhn, Z Zhang, MJ Langton
Journal of the American Chemical Society
(2023)
145
Chemical bonds in collagen rupture selectively under tensile stress.
J Rowe, K Röder
Physical Chemistry Chemical Physics
(2023)
25
Front Cover: Hybrid Androgen Receptor Inhibitors Outperform Enzalutamide and EPI‐001 in in vitro Models of Prostate Cancer Drug Resistance (ChemMedChem 2/2023)
RCB Nicolescu, ZR Maylin, FJ Pérez‐Areales, J Iegre, HS Pandha, M Asim, DR Spring
ChemMedChem
(2023)
18
In situ Detection of Cobaloxime Intermediates During Photocatalysis Using Hollow‐Core Photonic Crystal Fiber Microreactors
T Lawson, AS Gentleman, J Pinnell, A Eisenschmidt, D Antón‐García, MH Frosz, E Reisner, TG Euser
Angewandte Chemie
(2023)
135
Review of the design considerations for the laboratory growth of sea ice
B Hall, S Johnson, M Thomas, T Rampai
Journal of Glaciology
(2023)
69
Variational graph encoders: a surprisingly effective generalist algorithm for holistic computer-aided drug design
HYI Lam, R Pincket, H Han, XE Ong, Z Wang, W Li, J Hinks, L Zheng, Y Wei, Y Mu
(2023)