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- Currently displaying 6081 - 6100 of 29858 publications
Similarity transformation of the electronic Schrödinger equation via Jastrow factorization
Journal of Chemical Physics
(2019)
151
061101
(doi: 10.1063/1.5116024)
Topotactic Synthesis of Phosphabenzene-Functionalized Porous Organic Polymers: Efficient Ligands in CO2 Conversion
Angewandte Chemie International Edition
(2019)
58
13763
(doi: 10.1002/anie.201907015)
Redox-Guest-Induced Multimode Photoluminescence Switch for Sequential Logic Gates in a Photoactive Coordination Cage
Chemistry (Weinheim an der Bergstrasse, Germany)
(2019)
25
11903
(doi: 10.1002/chem.201901612)
Organoiron- and Fluoride-Catalyzed Phosphinidene Transfer to Styrenic Olefins in a Stereoselective Synthesis of Unprotected Phosphiranes
J Am Chem Soc
(2019)
141
13336
(doi: 10.1021/jacs.9b07069)
Predicting Macrocyclic Molecular Recognition with Machine Learning
(2019)
(doi: 10.26434/chemrxiv.9540068.v1)
Hyperuniformity and static structure factor of amorphous silicon in the infinite-wavelength limit
Journal of Physics: Conference Series
(2019)
1252
012003
Novel semiconducting iron–quinizarin metal–organic framework for application in supercapacitors*
Molecular Physics
(2019)
117
3424
The Contribution of Backbone Electrostatic Repulsion to DNA Mechanical Properties is Length-Scale-Dependent
The journal of physical chemistry letters
(2019)
10
4829
(doi: 10.1021/acs.jpclett.9b01960)
Modular supramolecular dimerization of optically tunable extended aryl viologens.
Chemical science
(2019)
10
8806
(doi: 10.1039/c9sc03057c)
Clear-sky ultraviolet radiation modelling using output from the Chemistry Climate Model Initiative
Atmospheric Chemistry and Physics
(2019)
19
10087
(doi: 10.5194/acp-19-10087-2019)
Elucidating Compound Mechanism of Action and Predicting Cytotoxicity Using Machine Learning Approaches, Taking Prediction Confidence into Account
Curr Protoc Chem Biol
(2019)
11
e73
(doi: 10.1002/cpch.73)
SLMP53-2 restoreswild-type-like function to mutant p53 through hsp70: Promising activity in hepatocellular carcinoma
Cancers
(2019)
11
E1151
(doi: 10.3390/cancers11081151)
A Practical Guide to the Simultaneous Determination of Protein Structure and Dynamics Using Metainference.
Methods in Molecular Biology
(2019)
2022
313
(doi: 10.1007/978-1-4939-9608-7_13)
Concepts and Applications of Conformal Prediction in Computational Drug
Discovery
(2019)
Phase behavior of empirical potentials of titanium dioxide
The Journal of Chemical Physics
(2019)
151
064505
(doi: 10.1063/1.5115161)
Particulate Photocatalysts for Light-Driven Water Splitting: Mechanisms, Challenges, and Design Strategies
Chem Rev
(2019)
120
919
(doi: 10.1021/acs.chemrev.9b00201)
Ethynylbenziodoxolone Reactivity in Cysteine Bioconjugation
Chem
(2019)
5
1932
(doi: 10.1016/j.chempr.2019.07.014)
Small molecule sequestration of amyloid-β as a drug discovery strategy for Alzheimer’s disease
(2019)
729392
(doi: 10.1101/729392)
Impact of Marginal Exciton–Charge-Transfer State Offset on Charge Generation and Recombination in Polymer:Fullerene Solar Cells
ACS Energy Letters
(2019)
4
2096
Effect of Aging on the Removal of Asphaltene Deposits with Aromatic Solvent.
Langmuir : the ACS journal of surfaces and colloids
(2019)
35
11995
(doi: 10.1021/acs.langmuir.9b01792)