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  • Currently displaying 1601 - 1620 of 29849 publications
Author(s)
Publication title
Journal Name
Publication year
Solvation rules: aromatic interactions outcompete cation–π interactions in synthetic host–guest complexes in water †
G Tobajas-Curiel, Q Sun, JKM Sanders, P Ballester, CA Hunter
Chemical Communications
(2023)
59
Open science discovery of potent noncovalent SARS-CoV-2 main protease inhibitors
ML Boby, D Fearon, M Ferla, M Filep, L Koekemoer, MC Robinson, COVID Moonshot Consortium‡, JD Chodera, AA Lee, N London, A von Delft, F von Delft, H Achdout, A Aimon, DS Alonzi, R Arbon, JC Aschenbrenner, BH Balcomb, E Bar-David, H Barr, A Ben-Shmuel, J Bennett, VA Bilenko, B Borden, P Boulet, GR Bowman, L Brewitz, J Brun, S Bvnbs, M Calmiano, A Carbery, DW Carney, E Cattermole, E Chang, E Chernyshenko, A Clyde, JE Coffland, G Cohen, JC Cole, A Contini, L Cox, TI Croll, M Cvitkovic, S De Jonghe, A Dias, K Donckers, DL Dotson, A Douangamath, S Duberstein, T Dudgeon, LE Dunnett, P Eastman, N Erez, CJ Eyermann, M Fairhead, G Fate, O Fedorov, RS Fernandes, L Ferrins, R Foster, H Foster, L Fraisse, R Gabizon, A García-Sastre, VO Gawriljuk, P Gehrtz, C Gileadi, C Giroud, WG Glass, RC Glen, I Glinert, AS Godoy, M Gorichko, T Gorrie-Stone, EJ Griffen, A Haneef, S Hassell Hart, J Heer, M Henry, M Hill, S Horrell, QYJ Huang, VD Huliak, MFD Hurley, T Israely, A Jajack, J Jansen, E Jnoff, D Jochmans, T John, B Kaminow, L Kang, AL Kantsadi, PW Kenny, JL Kiappes, SO Kinakh, B Kovar, T Krojer, VNT La, S Laghnimi-Hahn, BA Lefker, H Levy, RM Lithgo, IG Logvinenko, P Lukacik, HB Macdonald, EM MacLean, LL Makower, TR Malla, PG Marples, T Matviiuk, W McCorkindale, BL McGovern, S Melamed, KP Melnykov, O Michurin, P Miesen, H Mikolajek, BF Milne, D Minh, A Morris, GM Morris, MJ Morwitzer, D Moustakas, CE Mowbray, AM Nakamura, JB Neto, J Neyts, L Nguyen, GD Noske, V Oleinikovas, G Oliva, GJ Overheul, CD Owen, R Pai, J Pan, N Paran, AM Payne, B Perry, M Pingle, J Pinjari, B Politi, A Powell, V Pšenák, I Pulido, R Puni, VL Rangel, RN Reddi, P Rees, SP Reid, L Reid, E Resnick, EG Ripka, RP Robinson, J Rodriguez-Guerra, R Rosales, DA Rufa, K Saar, KS Saikatendu, E Salah, D Schaller, J Scheen, CA Schiffer, CJ Schofield, M Shafeev, A Shaikh, AM Shaqra, J Shi, K Shurrush, S Singh, A Sittner, P Sjö, R Skyner, A Smalley, B Smeets, MD Smilova, LJ Solmesky, J Spencer, C Strain-Damerell, V Swamy, H Tamir, JC Taylor, RE Tennant, W Thompson, A Thompson, S Tomásio, CWE Tomlinson, IS Tsurupa, A Tumber, I Vakonakis, RP van Rij, L Vangeel, FS Varghese, M Vaschetto, EB Vitner, V Voelz, A Volkamer, MA Walsh, W Ward, C Weatherall, S Weiss, KM White, CF Wild, KD Witt, M Wittmann, N Wright, Y Yahalom-Ronen, NK Yilmaz, D Zaidmann, I Zhang, H Zidane, N Zitzmann, SN Zvornicanin
Science
(2023)
382
Many-Body Methods for Surface Chemistry Come of Age: Achieving Consensus with Experiments.
BX Shi, A Zen, V Kapil, PR Nagy, A Grüneis, A Michaelides
J Am Chem Soc
(2023)
145
Synthetic yeast chromosome XI design provides a testbed for the study of extrachromosomal circular DNA dynamics.
BA Blount, X Lu, MRM Driessen, D Jovicevic, MI Sanchez, K Ciurkot, Y Zhao, S Lauer, RM McKiernan, G-OF Gowers, F Sweeney, V Fanfani, E Lobzaev, K Palacios-Flores, RSK Walker, A Hesketh, J Cai, SG Oliver, Y Cai, G Stracquadanio, LA Mitchell, JS Bader, JD Boeke, T Ellis
Cell genomics
(2023)
3
Driving electrochemical organic hydrogenations on metal catalysts by tailoring hydrogen surface coverages
T Li, A Ciotti, M Rahaman, CWS Yeung, M García-Melchor, E Reisner
(2023)
Landscapes of Finite Information
J McKittrick
(2023)
Automated multistep synthesis of 2-pyrazolines in continuous flow
SV Ley, R Labes, JC Pastre, RJ Ingham, C Battilocchio, HM Marçon, MCFCB Damião, DN Tran
Reaction Chemistry & Engineering
(2023)
9
NUMAC: Description of the Nested Unified Model With Aerosols and Chemistry, and Evaluation With KORUS-AQ Data
H Gordon, KS Carslaw, AA Hill, PR Field, NL Abraham, A Beyersdorf, C Corr‐Limoges, P Ghosh, J Hemmings, AC Jones, C Sanchez, X Wang, J Wilkinson
Journal of Advances in Modeling Earth Systems
(2023)
15
Synergistic solar-powered water-electricity generation: An integrated floating system on water
M Liu, Y Sun, K Shao, N Li, J Li, P Murto, Z Wang, J Chen, X Xu
Nano Energy
(2023)
119
Targeting nucleic acid phase transitions as a mechanism of action for antimicrobial peptides
T Sneideris
Nature Communications
(2023)
Automated Synthesis of Duplex-Forming Recognition-Encoded Oligomers
M Dhiman
(2023)
Targeting nucleic acid phase transitions as a mechanism of action for antimicrobial peptides
T Sneideris, NA Erkamp, H Ausserwöger, KL Saar, TJ Welsh, D Qian, K Katsuya-Gaviria, MLLY Johncock, G Krainer, A Borodavka, TPJ Knowles
Nat Commun
(2023)
14
Characterisation and Detection of P53 Aggregates
Y Wu
(2023)
Linking modulation of bio-molecular phase behaviour with collective interactions
D Qian, H Ausserwoger, WE Arter, RM Scrutton, TJ Welsh, T Kartanas, N Ermann, S Qamar, C Fischer, T Sneideris, P St George-Hyslop, RV Pappu, TPJ Knowles
(2023)
Synthesis and intramolecular singlet fission properties of ortho -phenylene linked oligomers of diphenylhexatriene
O Millington, A Sharma, S Montanaro, A Leventis, SA Dowland, DG Congrave, C-A Lee, A Rao, H Bronstein
Chemical Science
(2023)
14
Corrected density functional theory and the random phase approximation: Improved accuracy at little extra cost
D Graf, AJW Thom
Journal of Chemical Physics
(2023)
159
A Chinese longitudinal maternity cohort study (2013–2021) on intrahepatic cholestasis phenotypes: Risk associations from environmental exposure to adverse pregnancy outcomes
HZ Sun, H Tang, J Fang, H Dai, H Zhao, S Xu, Q Xiang, Y Tian, Y Jiao, T Luo, M Huang, J Shu, L Zang, H Liu, Y Guo, W Xu, X Bai, Zhejiang Environmental and Birth Health Research Alliance (ZEBRA) collaborative group
J Hazard Mater
(2023)
463
Mesoscale Simulations Reveal How Salt Influences Clay Particles Agglomeration in Aqueous Dispersions.
TTB Le, AR Finney, A Zen, T Bui, WJ Tay, K Chellappah, M Salvalaglio, A Michaelides, A Striolo
Journal of Chemical Theory and Computation
(2023)
20
Description and evaluation of the new UM–UKCA (vn11.0) Double Extended Stratospheric–Tropospheric (DEST vn1.0) scheme for comprehensive modelling of halogen chemistry in the stratosphere
EM Bednarz, R Hossaini, NL Abraham, MP Chipperfield
Geoscientific Model Development
(2023)
16
To Pair or not to Pair? Machine-Learned Explicitly-Correlated Electronic Structure for NaCl in Water
N O'Neill, BX Shi, K Fong, A Michaelides, C Schran
(2023)