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  • Currently displaying 2821 - 2840 of 30289 publications
Author(s)
Publication title
Journal Name
Publication year
Exploration and Exploitation Approaches Based on Generative Machine Learning to Identify Potent Small Molecule Inhibitors of α-Synuclein Secondary Nucleation
RI Horne, MH Murtada, D Huo, ZF Brotzakis, RC Gregory, A Possenti, S Chia, M Vendruscolo
Journal of Chemical Theory and Computation
(2023)
19
AlphaFold Prediction of Structural Ensembles of Disordered Proteins
ZF Brotzakis, S Zhang, M Vendruscolo
(2023)
Associations of air pollution mixtures with ambulatory blood pressure: The MobiliSense sensor-based study.
S Bista, L Chatzidiakou, RL Jones, T Benmarhnia, N Postel-Vinay, B Chaix
Environmental research
(2023)
227
The Influence of Protein Charge and Molecular Weight on the Affinity of Aptamers.
A Drees, TL Trinh, M Fischer
Pharmaceuticals
(2023)
16
A New Optimization Strategy of Highly Branched Poly(β-Amino Ester) for Enhanced Gene Delivery: Removal of Small Molecular Weight Components.
Y Li, X Wang, Z He, Z Li, M Johnson, B Qiu, R Song, S A, I Lara-Sáez, J Lyu, W Wang
Polymers
(2023)
15
Tracking the Photomineralization Mechanism in Irradiated Lab-Generated and Field-Collected Brown Carbon Samples and Its Effect on Cloud Condensation Nuclei Abilities.
S Müller, C Giorio, N Borduas-Dedekind
ACS Environ Au
(2023)
3
On-Chip Octanol-Assisted Liposome Assembly for Bioengineering.
C Chen, KA Ganar, S Deshpande
J Vis Exp
(2023)
Multidimensional Protein Solubility Optimization with an Ultrahigh- Throughput Microfluidic Platform
NA Erkamp, M Oeller, T Sneideris, H Ausserwoger, A Levin, TJ Welsh, R Qi, D Qian, N Lorenzen, H Zhu, P Sormanni, M Vendruscolo, TPJ Knowles
Analytical Chemistry
(2023)
95
Kinetic Analysis Reveals the Role of Secondary Nucleation in Regenerated Silk Fibroin Self-Assembly.
A Kamada, Z Toprakcioglu, TPJ Knowles
Biomacromolecules
(2023)
24
Comparison of Matsubara dynamics with exact quantum dynamics for an oscillator coupled to a dissipative bath
A Prada, ES Pós, SC Althorpe
The Journal of Chemical Physics
(2023)
158
Pantothenate biosynthesis in Toxoplasma gondii tachyzoites is not a drug target
VM Howieson, J Zeng, J Kloehn, C Spry, C Marchetti, M Lunghi, E Varesio, A Soper, AG Coyne, C Abell, GG van Dooren, KJ Saliba
International journal for parasitology. Drugs and drug resistance
(2023)
22
Direct Calculation of the Interfacial Free Energy between NaCl Crystal and Its Aqueous Solution at the Solubility Limit
I Sanchez-Burgos, JR Espinosa
Phys Rev Lett
(2023)
130
Scalable Palladium-Catalyzed C(sp3)-H Carbonylation of Alkylamines in Batch and Continuous Flow
J Zakrzewski, P Yaseneva, CJ Taylor, MJ Gaunt, AA Lapkin
Organic Process Research and Development
(2023)
27
Mechanism of action deconvolution of the small-molecule pathological tau aggregation inhibitor Anle138b
L Hosseini-Gerami, E Ficulle, N Humphryes-Kirilov, DC Airey, J Scherschel, S Kananathan, BJ Eastwood, S Bose, DA Collier, E Laing, D Evans, H Broughton, A Bender
Alzheimer's Research & Therapy
(2023)
15
Quantitative In Silico Prediction of the Rate of Protodeboronation by a Mechanistic Density Functional Theory-Aided Algorithm
DS Wigh, M Tissot, P Pasau, JM Goodman, AA Lapkin
Journal of Physical Chemistry A
(2023)
127
Triplet-encoded prebiotic RNA aminoacylation
M Su, C Schmitt, Z Liu, SJ Roberts, KC Liu, K Röder, A Jäschke, DJ Wales, JD Sutherland
(2023)
Mechanisms of adsorbing hydrogen gas on metal decorated graphene
YS Al-Hamdani, A Zen, A Michaelides, D Alfè
Physical Review Materials
(2023)
7
A Double-Walled Tetrahedron with AgI4 Vertices Binds Different Guests in Distinct Sites**
SE Clark, AW Heard, CT McTernan, TK Ronson, B Rossi, P Rozhin, S Marchesan, JR Nitschke
Angew Chem Int Ed Engl
(2023)
62
Chemical Validation of Mycobacterium tuberculosis Phosphopantetheine Adenylyltransferase Using Fragment Linking and CRISPR Interference**
J El Bakali, M Blaszczyk, JC Evans, JA Boland, WJ McCarthy, I Fathoni, MVB Dias, EO Johnson, AG Coyne, V Mizrahi, TL Blundell, C Abell, C Spry
Angew Chem Int Ed Engl
(2023)
62
Modulating Nucleic Acid Phase Transitions as a Mechanism of Action for Cell-Penetrating Antimicrobial Peptides
T Sneideris, NA Erkamp, H Ausserwöger, KL Saar, TJ Welsh, D Qian, MLLY Johncock, G Krainer, A Borodavka, TPJ Knowles
(2023)