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Currently displaying 4201 - 4220 of 30961 publications

Augmented Hill-Climb increases reinforcement learning efficiency for language-based de novo molecule generation

M Thomas, NM O'Boyle, A Bender, C de Graaf

(2022)

(doi: 10.26434/chemrxiv-2022-prz2r)

Reveal the Alignment of Defects in a Metal-Organic Framework with Tunable Flexibility

Y Fu, A Forse, Z Kang, M Cliffe, W Cao, J Yin, L Gao, Z Pang, T He, Q Chen, Q Wang, J Long, J Reimer, X Kong

(2022)

(doi: 10.21203/rs.3.rs-1173692/v1)

Prediction of In Vivo Pharmacokinetic Parameters and Time-Exposure Curves in Rats Using Machine Learning from the Chemical Structure.

O Obrezanova, A Martinsson, T Whitehead, S Mahmoud, A Bender, F Miljković, P Grabowski, B Irwin, I Oprisiu, G Conduit, M Segall, GF Smith, B Williamson, S Winiwarter, N Greene

Molecular pharmaceutics

(2022)

1488

(doi: 10.1021/acs.molpharmaceut.2c00027)

An Integrated Carbon Nitride-Nickel Photocatalyst for the Amination of Aryl Halides using Sodium Azide.

A Vijeta, C Casadevall, E Reisner

Angew Chem Int Ed Engl

(2022)

e202203176

(doi: 10.1002/anie.202203176)

Single-source Deposition of Mixed-metal Oxide Films Containing Zirconium and 3d Transition Metals for (Photo)electrocatalytic Water Oxidation

V Riesgo-Gonzalez, S Bhattacharjee, X Dong, DS Hall, V Andrei, AD Bond, CP Grey, E Reisner, DS Wright

Inorganic Chemistry: including bioinorganic chemistry

(2022)

6223

(doi: 10.1021/acs.inorgchem.2c00403)

Development of small cyclic peptides targeting the CK2α/β interface.

EL Atkinson, J Iegre, C D'Amore, P Brear, M Salvi, M Hyvönen, DR Spring

Chemical communications (Cambridge, England)

(2022)

4791

(doi: 10.1039/d2cc00707j)

Tuning the local chemical environment of ZnSe quantum dots with dithiols towards photocatalytic CO₂ reduction.

CD Sahm, A Ciotti, E Mates-Torres, V Badiani, K Sokołowski, G Neri, AJ Cowan, M García-Melchor, E Reisner

Chemical Science

(2022)

5988

(doi: 10.1039/d2sc00890d)

Micromechanics of soft materials using microfluidics

Y Xu, H Zhu, Y Shen, APM Guttenplan, KL Saar, Y Lu, D Vigolo, LS Itzhaki, TPJ Knowles

MRS Bulletin

(2022)

119

(doi: 10.1557/s43577-022-00279-5)

A Brain-Permeable Aminosterol Regulates Cell Membranes to Mitigate the Toxicity of Diverse Pore-Forming Agents.

RP Kreiser, AK Wright, LR Sasser, DJ Rinauro, JM Gabriel, CM Hsu, JA Hurtado, TL McKenzie, S Errico, JA Albright, L Richardson, VA Jaffett, DE Riegner, LT Nguyen, K LeForte, M Zasloff, JE Hollows, F Chiti, M Vendruscolo, R Limbocker

ACS Chemical Neuroscience

(2022)

1219

(doi: 10.1021/acschemneuro.1c00840)

Both COVID-19 infection and vaccination induce high-affinity cross-clade responses to SARS-CoV-2 variants

M Emmenegger, S Fiedler, SD Brugger, SRA Devenish, AS Morgunov, A Ilsley, F Ricci, AY Malik, T Scheier, L Batkitar, L Madrigal, M Rossi, AK Lynn, L Saleh, A von Eckardstein, TPJ Knowles, A Aguzzi

(2022)

(doi: 10.1101/2022.04.07.22273545)

A synthesis-enabled relative configurational assignment of the C31–C46 region of hemicalide

TP Stockdale, NYS Lam, I Paterson

Chemical communications (Cambridge, England)

(2022)

5729

(doi: 10.1039/d2cc01802k)