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  • Currently displaying 2901 - 2920 of 30398 publications
Author(s)
Publication title
Journal Name
Publication year
Is Unified Understanding of Vibrational Coupling of Water Possible? Hyper-Raman Measurement and Machine Learning Spectra
K Inoue, Y Litman, DM Wilkins, Y Nagata, M Okuno
J Phys Chem Lett
(2023)
14
Selective Aurora A-TPX2 interaction inhibitors havein vivoefficacy as targeted anti-mitotic agents
SR Stockwell, DE Scott, G Fischer, E Guarino, TPC Rooney, T-S Feng, T Moschetti, R Srinivasan, E Alza, A Asteian, C Dagostin, A Alcaide, M Rocaboy, B Blaszczyk, A Higueruelo, X Wang, M Rossmann, TR Perrior, TL Blundell, DR Spring, G McKenzie, C Abell, J Skidmore, AR Venkitaraman, M Hyvönen
(2023)
Covalent Organic Frameworks as Porous Pigments for Photocatalytic Metal-Free C-H Borylation.
A Basak, S Karak, R Banerjee
J Am Chem Soc
(2023)
145
α-synuclein oligomers displace monomeric α-synuclein from lipid membranes
G ŠneiderienÄ—, MA Czekalska, CK Xu, A Jayaram, G Krainer, WE Arter, Q Peter, M Castellana-Cruz, KL Saar, A Levin, T Mueller, S Fiedler, SRA Devenish, H Fiegler, JR Kumita, TPJ Knowles
(2023)
Simulations of DNA-origami self-assembly reveal design-dependent nucleation barriers
A Cumberworth, D Frenkel, A Reinhardt
(2023)
Interpreting vibrational circular dichroism spectra: the Cai•factor for absolute configuration with confidence.
J Goodman, RJ Lewis, J Lam
J Cheminform
(2023)
15
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
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 (Basel)
(2023)
15
The Influence of Protein Charge and Molecular Weight on the Affinity of Aptamers.
A Drees, TL Trinh, M Fischer
Pharmaceuticals (Basel, Switzerland)
(2023)
16
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 environmental Au
(2023)
3
On-Chip Octanol-Assisted Liposome Assembly for Bioengineering.
C Chen, KA Ganar, S Deshpande
Journal of Visualized Experiments
(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
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 & Development
(2023)
27
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
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
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
The journal of physical chemistry. A
(2023)
127