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  • Currently displaying 4261 - 4280 of 29261 publications
Author(s)
Publication title
Journal Name
Publication year
Comparison of Chemical Structure and Cell Morphology Information for Multitask Bioactivity Predictions
M-A Trapotsi, LH Mervin, AM Afzal, N Sturm, O Engkvist, IP Barrett, A Bender
J Chem Inf Model
(2021)
61
Model physics and chemistry causing intermodel disagreement within the VolMIP-Tambora Interactive Stratospheric Aerosol ensemble
M Clyne, J-F Lamarque, MJ Mills, M Khodri, W Ball, S Bekki, SS Dhomse, N Lebas, G Mann, L Marshall, U Niemeier, V Poulain, A Robock, E Rozanov, A Schmidt, A Stenke, T Sukhodolov, C Timmreck, M Toohey, F Tummon, D Zanchettin, Y Zhu, OB Toon
Atmospheric Chemistry and Physics
(2021)
21
Unsupervised classification of ozone profiles from UKESM1
F Fahrin, D Jones, Y Wu, A Archibald
(2021)
ZnSe Quantum Dots as a platform for solar fuels synthesis
CD Sahm
(2021)
Ligand-engineered bandgap stability in mixed-halide perovskite LEDs
Y Hassan, JH Park, ML Crawford, A Sadhanala, J Lee, JC Sadighian, E Mosconi, R Shivanna, E Radicchi, M Jeong, C Yang, H Choi, SH Park, MH Song, F De Angelis, CY Wong, RH Friend, BR Lee, HJ Snaith
Nature
(2021)
591
Visible‐Light Promoted C–O Bond Formation with an Integrated Carbon Nitride–Nickel Heterogeneous Photocatalyst
A Vijeta, C Casadevall, S Roy, E Reisner
Angewandte Chemie (Weinheim an der Bergstrasse, Germany)
(2021)
133
Visible-Light Promoted C-O Bond Formation with an Integrated Carbon Nitride-Nickel Heterogeneous Photocatalyst
A Vijeta, C Casadevall, S Roy, E Reisner
Angewandte Chemie (International ed. in English)
(2021)
60
Incorporation and evaluation of the CRI v2.2 chemical mechanism in UKESM1: An alternative mechanism with updated isoprene chemistry for investigating the influence of BVOCs on atmospheric composition and climate.
J Weber, S Archer-Nicholls, NL Abraham, YM Shin, T Bannan, R Schwantes, M Jenkin, A Khan, AT Archibald
(2021)
Structure‐based identification of dual ligands at the A 2A R and PDE10A with anti‐proliferative effects in lung cancer cell‐lines
L Kalash, I Winfield, D Safitri, M Bermudez, S Carvalho, R Glen, G Ladds, A Bender
Journal of cheminformatics
(2021)
13
Fragment-based computational design of antibodies targeting structured epitopes
MA Rangel, A Bedwell, E Costanzi, R Taylor, R Russo, GJL Bernardes, S Ricagno, J Frydman, M Vendruscolo, P Sormanni
(2021)
Comparison of Structure- and Ligand-Based Scoring Functions for Deep Generative Models: A GPCR Case Study
M Thomas, R Smith, NM O’Boyle, CD Graaf, A Bender
(2021)
Controlled self-assembly of natural proteins into hierarchically structured functional materials
A Kamada
(2021)
Fluorescence emission enhancement of a T-shaped benzimidazole with a mechanically-interlocked ‘suit’
H Xu, M-D Lin, J Yuan, B Zhou, Y Mu, Y Huo, K Zhu
Chemical communications (Cambridge, England)
(2021)
57
Making electrocatalytic materials from molecular catalysts
H Li, N Plumeré
Chem
(2021)
7
Ni-Catalyzed Cross-Electrophile Coupling of Aryl Triflates with Thiocarbonates via C-O/C-O Bond Cleavage
Z Zhu, Y Gong, W Tong, W Xue, H Gong
Organic letters
(2021)
23
Semi-Artificial Photoelectrochemistry through Perovskite Integration and Elucidation of the Local Environment
EE Moore
(2021)
Adsorption and cracking of propane by zeolites of different pore size
F Berger, M Rybicki, J Sauer
Journal of Catalysis
(2021)
395
Enhancement of infrared emissivity by the hierarchical microstructures from the wing scales of butterfly Rapala dioetas
C Lou, S An, R Yang, H Zhu, Q Shen, M Jiang, B Fu, P Tao, C Song, T Deng, W Shang
APL Photonics
(2021)
6
Graphene oxide induced enhancement of light-driven micromotor with biocompatible fuels
Q Yang, H Xu, H Wen, H Zhao, X Liu, Y Cai, H Wang, R Dong
Applied Materials Today
(2021)
22
Intercomparison of the representations of the atmospheric chemistry of pre-industrial methane and ozone in earth system and other global chemistry-transport models
RG Derwent, DD Parrish, AT Archibald, M Deushi, SE Bauer, K Tsigaridis, D Shindell, LW Horowitz, MAH Khan, DE Shallcross
Atmospheric Environment
(2021)
248