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- Currently displaying 6121 - 6140 of 29222 publications
Physisorption of Water on Graphene: Subchemical Accuracy from Many-Body Electronic Structure Methods
– J Phys Chem Lett
(2019)
10,
358
(doi: 10.1021/acs.jpclett.8b03679)
Computational Prediction of Site of Metabolism for UGT-Catalyzed Reactions
– Journal of Chemical Information and Modeling
(2019)
59,
1085
(doi: 10.1021/acs.jcim.8b00851)
Synthesis of novel trans-4-(phthalimidomethyl)- and 4-(imidazol-1-ylmethyl)-3-indolyl-tetrahydroisoquinolinones as possible aromatase inhibitors
– Chemical Papers
(2019)
73,
1263
(doi: 10.1007/s11696-018-00677-7)
Spectrally-Resolved Photodynamics of Individual Emitters in Large-Area Monolayers of Hexagonal-Boron Nitride
(2019)
(doi: 10.48550/arxiv.1901.02793)
Effects of α-tubulin acetylation on microtubule structure and stability
(2019)
516591
(doi: 10.1101/516591)
Communication—A Method to Measure Extremely Low Corrosion Rates of Copper Metal in Anoxic Aqueous Media
– Journal of The Electrochemical Society
(2019)
166,
C3015
(doi: 10.1149/2.0031911jes)
Hydrogen-Bond-Assisted Symmetry Breaking in a Network of Chiral Metal–Organic Assemblies
– J Am Chem Soc
(2019)
141,
1707
(doi: 10.1021/jacs.8b12323)
Energy Landscape for Fold-Switching in Regulatory Protein RfaH
– J Chem Theory Comput
(2019)
15,
731
(doi: 10.1021/acs.jctc.8b00912)
Physical determinants of amyloid assembly in biofilm formation
– mBio
(2019)
10,
e02279
(doi: 10.1128/mBio.02279-18)
Energy Landscapes for Proteins: From Single Funnels to Multifunctional Systems
– Advanced Theory and Simulations
(2019)
2,
1800175
(doi: 10.1002/adts.201800175)
Exciting Determinants in Quantum Monte Carlo: Loading the Dice with Fast, Low-Memory Weights.
– Journal of Chemical Theory and Computation
(2019)
15,
127
(doi: 10.1021/acs.jctc.8b00844)
Dual-catalytic transition metal systems for functionalization of unreactive sites of molecules
– Nature Catalysis
(2019)
2,
114
(doi: 10.1038/s41929-018-0207-1)
Crystal structure, non-covalent interaction and molecular docking studies of 2-{[2-phenylsulfonyl)hydrazinylidene]methyl}benzoic acid and its dysprosium catalysed cyclized product: 2-(phenyl-sulfonyl)phthalazin-1(2H)-one
– Journal of Molecular Structure
(2019)
1175,
219
Halogen-bonded cocrystallization with phosphorus, arsenic and antimony acceptors.
– Nat Commun
(2019)
10,
61
(doi: 10.1038/s41467-018-07957-6)
ESD Ideas: Photoelectrochemical carbon removal as negative emission technology
– Earth System Dynamics
(2019)
10,
1
(doi: 10.5194/esd-10-1-2019)
Synthesis and encapsulation of V(IV,V) compounds in silica nanoparticles targeting development of antioxidant and antiradical nanomaterials
– Journal of inorganic biochemistry
(2019)
194,
180
Computational Investigation of RNA A-Bulges Related to the Microtubule-Associated Protein Tau Causing Frontotemporal Dementia and Parkinsonism
– The journal of physical chemistry. B
(2019)
123,
57
(doi: 10.1021/acs.jpcb.8b09139)
Modulating the Cellular Uptake of Fluorescently Tagged Substrates of Prostate-Specific Antigen before and after Enzymatic Activation.
– Bioconjug Chem
(2019)
30,
124
Correction: Unexpected arene ligand exchange results in the oxidation of an organoruthenium anticancer agent: the first X-ray structure of a protein-Ru(carbene) adduct.
– Chemical Communications
(2019)
55,
716
(doi: 10.1039/C8CC90551G)
Formation Mechanisms of ZnO Spherulites and Derivatives
– Crystal Growth & Design
(2019)
19,
249
(doi: 10.1021/acs.cgd.8b01332)