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- Currently displaying 1201 - 1220 of 29940 publications
Advancing AI protein structure prediction and design: From amino acid “bones” to new era of all-atom “flesh”
Green Carbon
(2024)
2
209
Co-aggregation with Apolipoprotein E modulates the function of Amyloid-β in Alzheimer's disease
Nature Communications
(2024)
15
4695
(doi: 10.1038/s41467-024-49028-z)
Steric Control over Interligand Dihedrals and Splay Leads to the Formation of Fe II 6 L 6 and Fe II 8 L 8 Antiprisms
Ccs Chemistry
(2024)
6
2411
The diversity ofSNCAtranscripts in neurons, and its impact on antisense oligonucleotide therapeutics
(2024)
(doi: 10.1101/2024.05.30.596437)
Modular Approaches for the Synthesis of α-Azinyl Amines and Related Scaffolds
(2024)
(doi: 10.17863/CAM.111484)
Influence of point mutations on PR65 conformational adaptability: Insights from molecular simulations and nanoaperture optical tweezers
Science Advances
(2024)
10
eadn2208
(doi: 10.1126/sciadv.adn2208)
To Pair or Not to Pair? Machine-Learned Explicitly-Correlated Electronic Structure for NaCl in Water
Journal of Physical Chemistry Letters
(2024)
15
6081
(doi: 10.1021/acs.jpclett.4c01030)
Manganese( ii ) promotes prebiotically plausible non-enzymatic RNA ligation reactions †
Chemical Communications
(2024)
60
6528
(doi: 10.1039/d4cc01086h)
Local Structure and Dynamics in MPt(CN)6 Prussian Blue Analogues
Chemistry of materials : a publication of the American Chemical Society
(2024)
36
5796
MolScore: a scoring, evaluation and benchmarking framework for generative models in de novo drug design.
J Cheminform
(2024)
16
64
(doi: 10.1186/s13321-024-00861-w)
Data-efficient fine-tuning of foundational models for first-principles quality sublimation enthalpies
(2024)
(doi: 10.48550/arxiv.2405.20217)
Light management by algal aggregates in living photosynthetic hydrogels
Proc Natl Acad Sci U S A
(2024)
121
e2316206121
(doi: 10.1073/pnas.2316206121)
Learning Electronic Polarizations in Aqueous Systems.
Journal of Chemical Information and Modeling
(2024)
64
4426
(doi: 10.1021/acs.jcim.4c00421)
i-PI 3.0: a flexible and efficient framework for advanced atomistic
simulations
(2024)
Aβ Oligomer Dissociation Is Catalyzed by Fibril Surfaces
ACS chemical neuroscience
(2024)
15
2296
(doi: 10.1021/acschemneuro.4c00127)
Palladium catalysts supported on biodegradable urea-based polymers in synthesis with CO - Part B
Catalysis Today
(2024)
440
114831
(doi: 10.1016/j.cattod.2024.114831)
An evolutionarily conserved mechanism controls reversible amyloids of pyruvate kinase via pH-sensing regions.
Developmental cell
(2024)
59
1876
(doi: 10.1016/j.devcel.2024.04.018)
Solutes unmask differences in clustering versus phase separation of FET proteins.
Nature Communications
(2024)
15
4408
(doi: 10.1038/s41467-024-48775-3)
Biomolecular condensates sustain pH gradients at equilibrium through charge neutralisation
(2024)
(doi: 10.1101/2024.05.23.595321)
Emerging Mesoscale Flows and Chaotic Advection in Dense Active Matter.
Phys Rev Lett
(2024)
132
218301