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  • Currently displaying 3701 - 3720 of 29853 publications
Author(s)
Publication title
Journal Name
Publication year
On the "Matsubara heating" of overtone intensities and Fermi splittings.
RL Benson, SC Althorpe
Journal of Chemical Physics
(2021)
155
In silico approaches in organ toxicity hazard assessment: Current status and future needs in predicting liver toxicity
A Bassan, VM Alves, A Amberg, LT Anger, S Auerbach, L Beilke, A Bender, MTD Cronin, KP Cross, J-H Hsieh, N Greene, R Kemper, MT Kim, M Mumtaz, T Noeske, M Pavan, J Pletz, DP Russo, Y Sabnis, M Schaefer, DT Szabo, J-P Valentin, J Wichard, D Williams, D Woolley, C Zwickl, GJ Myatt
Comput Toxicol
(2021)
20
Myths of high-throughput experimentation and automation in chemistry
MJ Gaunt, JM Janey, DM Schultz, T Cernak
Chem
(2021)
7
Impacts of Hydroperoxymethyl Thioformate on the Global Marine Sulfur Budget
MAH Khan, TJ Bannan, R Holland, DE Shallcross, AT Archibald, E Matthews, A Back, J Allan, H Coe, P Artaxo, CJ Percival
ACS Earth and Space Chemistry
(2021)
5
The Influence of Chemical and Mineral Compositions on the Parameterization of Immersion Freezing by Volcanic Ash Particles
NS Umo, R Ullrich, EC Maters, I Steinke, N Benker, K Höhler, R Wagner, PG Weidler, GA Hoshyaripour, A Kiselev, U Kueppers, K Kandler, DB Dingwell, T Leisner, O Möhler
Journal of Geophysical Research: Atmospheres
(2021)
126
Visible light-mediated radical fluoromethylation via halogen atom transfer activation of fluoroiodomethane
PJ Deneny, R Kumar, MJ Gaunt
Chemical Science
(2021)
12
Inhibition of Class A β-Lactamase (TEM-1) by Narrow Fractions of Humic Substances.
TA Mikhnevich, AV Vyatkina Turkova, VG Grigorenko, MY Rubtsova, GD Rukhovich, MA Letarova, DS Kravtsova, SA Vladimirov, AA Orlov, EN Nikolaev, A Zherebker, IV Perminova
ACS omega
(2021)
6
Overcoming Metastable CO2 Adsorption in a Bulky Diamine-Appended Metal-Organic Framework
B Dinakar, AC Forse, HZH Jiang, Z Zhu, J-H Lee, EJ Kim, ST Parker, CJ Pollak, RL Siegelman, PJ Milner, JA Reimer, JR Long
Journal of the American Chemical Society
(2021)
143
Truce–Smiles Rearrangements by Strain Release: Harnessing Primary Alkyl Radicals for Metal‐Free Arylation
DM Whalley, J Seayad, MF Greaney
Angewandte Chemie International Edition
(2021)
60
Minimal Design Principles for Icosahedral Virus Capsids.
M Martín-Bravo, JMG Llorente, J Hernández-Rojas, DJ Wales
ACS nano
(2021)
15
New Frontiers for Machine Learning in Protein Science
AS Morgunov, KL Saar, M Vendruscolo, TPJ Knowles
J Mol Biol
(2021)
433
Aggregation Condition–Structure Relationship of Mouse Prion Protein Fibrils
J Fridmanis, Z Toleikis, T Sneideris, M Ziaunys, R Bobrovs, V Smirnovas, K Jaudzems
Int J Mol Sci
(2021)
22
Halogen‐Bonding Strapped Porphyrin BODIPY Rotaxanes for Dual Optical and Electrochemical Anion Sensing
Y Cheong Tse, R Hein, EJ Mitchell, Z Zhang, PD Beer
Chemistry (Weinheim an der Bergstrasse, Germany)
(2021)
27
Iron(II)-Catalyzed Aerobic Biomimetic Oxidation of N-Heterocycles.
S Manna, W-J Kong, J-E Bäckvall
Chemistry A European Journal
(2021)
27
Single-route delaminated clay composites for efficient visible-light photo-mineralization of antibiotic-resistant bacteria and associated genes in water
CG Ugwuja, D Olorunnisola, A Ogunlaja, OO Adelowo, A Taubert, GA Kolawole, OD Olukanni, JN Uwanibe, AT Kayode, P Hesemann, D Fatta-Kassinos, TAM Msagati, OA Folarin, SM Clarke, EI Unuabonah
Applied Catalysis B Environment and Energy
(2021)
292
Protein Structure Prediction Using a Maximum Likelihood Formulation of a Recurrent Geometric Network
G Qi, MR Tollefson, RA Gogal, RJH Smith, M AlQuraishi, MJ Schnieders
(2021)
Assessment of Therapeutic AntibodyDevelopability by Combinations of In Vitro and In Silico Methods
A-M Wolf Pérez, N Lorenzen, M Vendruscolo, P Sormanni
Methods in Molecular Biology
(2021)
2313
Prediction and identification of synergistic compound combinations against pancreatic cancer cells
Y KalantarMotamedi, RJ Choi, S-B Koh, JL Bramhall, T-P Fan, A Bender
iScience
(2021)
24
A fast, low-energy multi-state phase-change artificial synapse based on uniform partial-state transitions
SX Go, TH Lee, SR Elliott, N Bajalovic, DK Loke
APL Materials
(2021)
9
Synthesis of a Diverse and Three-Dimensional Fragment Collection and The Development of a Novel Platform for Antibody Dual Functionalisation
AR Hanby
(2021)