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  • Currently displaying 4701 - 4720 of 30150 publications
Author(s)
Publication title
Journal Name
Publication year
Towards the development of a visible light-enabled histidine-selective protein modification strategy using diazo sulfonium-based probes
S Folliet
(2021)
Free energies of crystals computed using Einstein crystal with fixed center of mass and differing spring constants
V Khanna, J Anwar, D Frenkel, MF Doherty, B Peters
Journal of Chemical Physics
(2021)
154
Chalcogen Bonding Ion-Pair Cryptand Host Discrimination of Potassium Halide Salts.
A Docker, T Bunchuay, M Ahrens, AJ Martinez-Martinez, PD Beer
Chemistry (Weinheim an der Bergstrasse, Germany)
(2021)
27
Creating custom synthetic genomes in Escherichia coli with REXER and GENESIS
WE Robertson, LFH Funke, D de la Torre, J Fredens, K Wang, JW Chin
Nature Protocols
(2021)
16
LAG3 is not expressed in human and murine neurons and does not modulate α-synucleinopathies
M Emmenegger, E De Cecco, M Hruska-Plochan, T Eninger, MM Schneider, M Barth, E Tantardini, P de Rossi, M Bacioglu, RG Langston, A Kaganovich, N Bengoa-Vergniory, A Gonzalez-Guerra, M Avar, D Heinzer, R Reimann, LM Häsler, TW Herling, NS Matharu, N Landeck, K Luk, R Melki, PJ Kahle, S Hornemann, TPJ Knowles, MR Cookson, M Polymenidou, M Jucker, A Aguzzi
(2021)
G-quadruplexes are transcription factor binding hubs in human chromatin
J Spiegel, SM Cuesta, S Adhikari, R Hänsel-Hertsch, D Tannahill, S Balasubramanian
Genome Biology
(2021)
22
Insights Into the Electric Double-Layer Capacitance of the Two-Dimensional Electrically Conductive Metal-Organic Framework Cu3(HHTP)2
JW Gittins, CJ Balhatchet, Y Chen, C Liu, DG Madden, S Britto, M Golomb, A Walsh, D Fairen-Jimenez, S Dutton, AC Forse
(2021)
Comparative Study of Single-Atom Gold and Iridium on CeO2{111}
CJ Owen, SJ Jenkins
The Journal of Chemical Physics
(2021)
154
Modelling Mullins effect induced by chain delamination and reattachment
D Qian, F Meng
Polymer
(2021)
222
Surface Chirality Influences Molecular Rotation upon Desorption
SC Matysik, DJ Wales, SJ Jenkins
Physical Review Letters
(2021)
126
Reduced variance analysis of molecular dynamics simulations by linear combination of estimators
SW Coles, E Mangaud, D Frenkel, B Rotenberg
(2021)
Nature of enhanced brønsted acidity induced by extraframework aluminum in an ultrastabilized faujasite zeolite: An in situ NMR study: Published as part of the Journal of Physical Chemistry virtual special issue "advanced Characterization by Solid-State NMR and in Situ Technology"
B Mezari, PCMM Magusin, SMT Almutairi, EA Pidko, EJM Hensen
The Journal of Physical Chemistry C
(2021)
125
A full configuration interaction quantum Monte Carlo study of ScO, TiO, and VO molecules
T Jiang, Y Chen, NA Bogdanov, E Wang, A Alavi, J Chen
Journal of Chemical Physics
(2021)
154
G392E neuroserpin causing the dementia FENIB is secreted from cells but is not synaptotoxic
T Ingwersen, C Linnenberg, E D'Acunto, S Temori, I Paolucci, D Wasilewski, B Mohammadi, J Kirchmair, RC Glen, E Miranda, M Glatzel, G Galliciotti
Sci Rep
(2021)
11
Porous Covalent Organic Nanotubes and Toroids: A Carbon Nanotube Analogue
R Banerjee, K Koner, S Karak, S Kandambeth, S Karak, N Thomas, L Leanza, C Perego, L Pesce, R Capelli, M Moun, M Bhakar, TG Ajithkumar, G Pavan
(2021)
Crystal structure prediction for benzene using basin-hopping global optimization
A Banerjee, D Jasrasaria, SP Niblett, DJ Wales
The Journal of Physical Chemistry A
(2021)
125
Phosphirenium ions as masked phosphenium Catalysts: Mechanistic evaluation and application in synthesis
D Gasperini, SE Neale, MF Mahon, SA Macgregor, RL Webster
ACS catalysis
(2021)
11
Multi-task Bayesian Optimization of Chemical Reactions
K Felton, D Wigh, A Lapkin
(2021)
Antibody Affinity Governs the Inhibition of SARS-CoV-2 Spike/ACE2 Binding in Patient Serum
S Fiedler, MA Piziorska, V Denninger, AS Morgunov, A Ilsley, AY Malik, MM Schneider, SRA Devenish, G Meisl, V Kosmoliaptsis, A Aguzzi, H Fiegler, TPJ Knowles
ACS Infectious Diseases
(2021)
7
Critical assessment of protein intrinsic disorder prediction
M Necci, D Piovesan, CAID Predictors, DisProt Curators, SCE Tosatto
Nature methods
(2021)
18