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- Currently displaying 8701 - 8720 of 31546 publications
Determination of Structural Ensembles of Proteins: Restraining vs Reweighting.
J Chem Theory Comput
(2018)
14
6632
(doi: 10.1021/acs.jctc.8b00738)
Drop-on-Demand 3D Printing of Lithium Iron Phosphate Cathodes
Journal of The Electrochemical Society
(2018)
166
A5059
(doi: 10.1149/2.0091903jes)
Computational Surface Chemistry of Tetrahedral Amorphous Carbon by Combining Machine Learning and Density Functional Theory
Chemistry of Materials
(2018)
30
7438
Cisplatin-Triggered Bioorthogonal Decaging of Amide Bonds for Targeted-Drug Activation in vivo
(2018)
(doi: 10.26434/chemrxiv.7327904.v1)
Tropospheric ozone in CCMI models and Gaussian process emulation to understand biases in the SOCOLv3 chemistry-climate model
Atmospheric chemistry and physics
(2018)
18
16155
(doi: 10.5194/acp-18-16155-2018)
Reactivity of Amorphous Carbon Surfaces: Rationalizing the Role of Structural Motifs in Functionalization Using Machine Learning
Chemistry of Materials
(2018)
30
7446
Across‐the‐World Automated Optimization and Continuous‐Flow Synthesis of Pharmaceutical Agents Operating Through a Cloud‐Based Server
Angewandte Chemie
(2018)
130
15348
(doi: 10.1002/ange.201809080)
Across‐the‐World Automated Optimization and Continuous‐Flow Synthesis of Pharmaceutical Agents Operating Through a Cloud‐Based Server
Angewandte Chemie (International ed. in English)
(2018)
57
15128
(doi: 10.1002/anie.201809080)
Machine Learning for Analysis of Time-Resolved Luminescence Data
ACS Photonics
(2018)
5
4888
(doi: 10.1021/acsphotonics.8b01047)
Hydrogen Evolution from Aqueous Solutions Mediated by a Heterogenized [NiFe]-Hydrogenase Model: Low pH Enables Catalysis through an Enzyme-Relevant Mechanism
Angewandte Chemie (International ed. in English)
(2018)
57
16001
(doi: 10.1002/anie.201808215)
Filamentous aggregates are fragmented by the proteasome holoenzyme
Cell Reports
(2018)
467068
(doi: 10.1101/467068)
Novel near-infrared II aggregation-induced emission dots for in vivo bioimaging
Chem Sci
(2018)
10
1219
(doi: 10.1039/c8sc04363a)
Designing schools for health, comfort and cognitive performance: What do we know?
(2018)
149
(doi: 10.4324/9781315148366-9)
Reusable Immobilized Iron(II) Nanoparticle Precatalysts for Ligand-Free Kumada Coupling
ACS Applied Nano Materials
(2018)
1
6950
(doi: 10.1021/acsanm.8b01742)
Non-Native Cooperative Interactions Modulate Protein Folding Rates
The journal of physical chemistry. B
(2018)
122
10817
(doi: 10.1021/acs.jpcb.8b08990)
Visualization of Anisotropic and Stepwise Piezofluorochromism in an MOF Single Crystal
Chem
(2018)
4
2658
(doi: 10.1016/j.chempr.2018.08.025)
Systemic neurotransmitter responses to clinically approved and experimental neuropsychiatric drugs.
Nat Commun
(2018)
9
4699
(doi: 10.1038/s41467-018-07239-1)
Information-driven inverse approach to disordered solids: Applications to amorphous silicon
Physical Review Materials
(2018)
2
115602
From Catalysis to Cancer: Toward Structure-Activity Relationships for Benzimidazol-2-ylidene-Derived N-Heterocyclic-Carbene Complexes as Anticancer Agents
Inorg Chem
(2018)
57
14427
Engineering New Defective Phases of UiO Family Metal-Organic Frameworks with Water
(2018)
(doi: 10.26434/chemrxiv.7301951)