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PubPharm (76)
1
Publisher Correction : An integrated high-throughput robotic platform and active learning approach for accelerated discovery of optimal electrolyte formulations
enthalten in:
Nature communications
| 2024
von
Noh, J.
|
Doan, H.
|
Job, H.
| +6
ErratumFor: Nat Commun. 2024 Mar 29;15(1):2757. - PMID 38553488
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2
An integrated high-throughput robotic platform and active learning approach for accelerated discovery of optimal electrolyte formulations
enthalten in:
Nature communications
| 2024
von
Noh, J.
|
Doan, H.
|
Job, H.
| +6
ErratumIn: Nat Commun. 2024 Apr 11;15(1):3150. - PMID 38605070
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3
Emin : A First-Principles Thermochemical Descriptor for Predicting Molecular Synthesizability
enthalten in:
Journal of chemical information and modeling
| 2024
von
Lee, A.
|
Elliott, S.
|
Harb, H.
| +4
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4
E_min: A First-Principles Thermochemical Descriptor for Predicting Molecular Synthesizability
enthalten in:
chemRxiv.org
| 2024
von
Lee, A.
|
Elliott, S.
|
Harb, H.
| +4
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5
Mixed-Anion Contact Ion-Pair Formation Enabling Improved Performance of Halide-Free Mg-Ion Electrolytes
enthalten in:
ACS applied materials & interfaces
| 2024
von
Ilic, S.
|
Lavan, S.
|
Leon, N.
| +6
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6
Active Learning Guided Computational Discovery of Plant-Based Redoxmers for Organic Nonaqueous Redox Flow Batteries
enthalten in:
ACS applied materials & interfaces
| 2023
von
Jain, A.
|
Shkrob, I.
|
Doan, H.
| +3
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7
Shape-persistent ladder molecules exhibit nanogap-independent conductance in single-molecule junctions
enthalten in:
chemRxiv.org
| 2023
von
Liu, X.
|
Yang, H.
|
Harb, H.
| +9
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8
Accurate Prediction of Adiabatic Ionization Potentials of Organic Molecules using Quantum Chemistry Assisted Machine Learning
enthalten in:
The journal of physical chemistry. A
| 2023
von
Dandu, N.
|
Ward, L.
|
Assary, R.
| +2
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9
Mechanistic Insights into the Catalytic Condensation of Methyl Ketones on MgO Surfaces
enthalten in:
Chemical Research in Chinese Universities
| 2023
von
Zhou, M.
|
Curtiss, L.
|
Assary, R.
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10
Coordination-Dependent Chemical Reactivity of TFSI Anions at a Mg Metal Interface
enthalten in:
ACS applied materials & interfaces
| 2023
von
Prabhakaran, V.
|
Agarwal, G.
|
Howard, J.
| +14
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The journal of physical chemistry. A
7
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5
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4
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Thema
42
Journal Article
16
Research Support, U.S. Gov't, Non-P.H.S.
8
Research Support, Non-U.S. Gov't
5
540
5
Chemistry
4
DJ1HGI319P
4
Furaldehyde
3
5-hydroxymethylfurfural
3
70ETD81LF0
3
Enzyme screening
3
Ethers
3
Molecular modeling
3
Novel biochemical transformations
3
density functional theory
2
059QF0KO0R
2
30237-26-4
2
7440-44-0
2
8558G7RUTR
2
9FN79X2M3F
2
Acids
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Erscheinungszeitraum
25
2020-
51
2010-2019
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Sprache
53
Englisch
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