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- Currently displaying 6881 - 6900 of 29644 publications
i-PI 2.0: A universal force engine for advanced molecular simulations
Computer Physics Communications
(2019)
236
214
(doi: 10.1016/j.cpc.2018.09.020)
Fragment-based discovery of a new class of inhibitors targeting mycobacterial tRNA modification
(2019)
(doi: 10.1101/564013)
2‑Aminothiazole Derivatives as Selective Allosteric Modulators of the Protein Kinase CK2. 1. Identification of an Allosteric Binding Site
Journal of medicinal chemistry
(2019)
62
1803
(doi: 10.1021/acs.jmedchem.8b01766)
Enantioselective Synthesis of Homochiral Au 13 Nanoclusters and Their Chiroptical Activities
Inorg Chem
(2019)
58
3670
2‑Aminothiazole Derivatives as Selective Allosteric Modulators of the Protein Kinase CK2. 2. Structure-Based Optimization and Investigation of Effects Specific to the Allosteric Mode of Action
Journal of medicinal chemistry
(2019)
62
1817
(doi: 10.1021/acs.jmedchem.8b01765)
Enabling synthesis in fragment-based drug discovery by reactivity mapping: photoredox-mediated cross-dehydrogenative heteroarylation of cyclic amines
Chemical science
(2019)
10
2264
(doi: 10.1039/c8sc04789h)
Cocrystal Dissociation under Controlled Humidity: A Case Study of Caffeine-Glutaric Acid Cocrystal Polymorphs
Organic Process Research and Development
(2019)
23
845
(doi: 10.1021/acs.oprd.8b00422)
On the anomaly in the electrical characteristics of thin film transistors with multi-layered sol-gel processed ZnO
Thin Solid Films
(2019)
672
152
(doi: 10.1016/j.tsf.2019.01.015)
Inside Cover: Fluorometric Recognition of Nucleotides within a Water‐Soluble Tetrahedral Capsule (Angew. Chem. Int. Ed. 13/2019)
Angewandte Chemie International Edition
(2019)
58
4068
(doi: 10.1002/anie.201902025)
Phosphine-Catalyzed (3+2) Annulation of Isoindigos with Allenes: Enantioselective Formation of Two Vicinal Quaternary Stereogenic Centers
Angewandte Chemie International Edition
(2019)
58
6260
(doi: 10.1002/anie.201900758)
Direct target and non-target analysis of urban aerosol sample extracts using atmospheric pressure photoionisation high-resolution mass spectrometry
Chemosphere
(2019)
224
786
Synthesis and Electrochemical Activity of Some Na(Li)‐Rich Ruthenium Oxides with the Feasibility to Stabilize Ru6+
Advanced Energy Materials
(2019)
9
1803674
(doi: 10.1002/aenm.201803674)
Properties of Polyetheretherketone (PEEK) transferred materials in a PEEK-steel contact
Tribology International
(2019)
135
189
Innentitelbild: Fluorometric Recognition of Nucleotides within a Water‐Soluble Tetrahedral Capsule (Angew. Chem. 13/2019)
Angewandte Chemie
(2019)
131
4110
(doi: 10.1002/ange.201902025)
In Silico Prediction of Endocrine Disrupting Chemicals Using Single-Label and Multilabel Models.
J Chem Inf Model
(2019)
59
973
(doi: 10.1021/acs.jcim.8b00551)
Anticipating Acene-Based Chromophore Spectra with Molecular Orbital Arguments
Journal of Physical Chemistry A
(2019)
123
2527
(doi: 10.1021/acs.jpca.8b12222)
Emissive Synthetic Cofactors: A Highly Responsive NAD+ Analogue Reveals Biomolecular Recognition Features.
Chemistry – A European Journal
(2019)
25
4379
(doi: 10.1002/chem.201805520)
Layered CeSO and LiCeSO Oxide Chalcogenides Obtained via Topotactic Oxidative and Reductive Transformations.
Inorg Chem
(2019)
58
3838
Porosity Switching in Polymorphic Porous Organic Cages with Exceptional Chemical Stability
Angewandte Chemie
(2019)
131
4287
(doi: 10.1002/ange.201813773)