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- Currently displaying 9921 - 9940 of 29910 publications
Linked coupled cluster Monte Carlo
The Journal of chemical physics
(2016)
144
044111
(doi: 10.1063/1.4940317)
Trigonal (-3) symmetry octahedral lanthanide(III) complexes of zwitterionic tripodal ligands: Luminescence and magnetism
Supramolecular Chemistry
(2016)
28
125
Development and performance of iron based oxygen carriers containing calcium ferrites for chemical looping combustion and production of hydrogen
International Journal of Hydrogen Energy
(2016)
41
4073
Time Evolution of the Wettability of Supported Graphene under Ambient Air Exposure.
The journal of physical chemistry. C, Nanomaterials and interfaces
(2016)
120
2215
(doi: 10.1021/acs.jpcc.5b10492)
Hofmeister Ion-Induced Changes in Water Structure Correlate with Changes in Solvation of an Aggregated Protein Complex
Langmuir
(2016)
32
1360
(doi: 10.1021/acs.langmuir.5b04489)
The impact of residential combustion emissions on atmospheric aerosol, human health, and climate
Atmospheric Chemistry and Physics
(2016)
16
873
(doi: 10.5194/acp-16-873-2016)
Locating Instantons in Calculations of Tunneling Splittings: The Test Case of Malonaldehyde.
J Chem Theory Comput
(2016)
12
787
(doi: 10.1021/acs.jctc.5b01073)
Turning intractable counting into sampling: Computing the configurational entropy of three-dimensional jammed packings.
Physical review. E
(2016)
93
012906
(doi: 10.1103/PhysRevE.93.012906)
A fragment merging approach towards the development of small molecule inhibitors of Mycobacterium tuberculosis EthR for use as ethionamide boosters
Organic and Biomolecular Chemistry
(2016)
14
2318
(doi: 10.1039/c5ob02630j)
Crystal structures of a family of layered coordination polymers containing divalent metal ions (Mn2+, Co2+, Ni2+ and Zn2+) and the 3-amino 4-methyl benzoate ion
Journal of Structural Chemistry
(2016)
56
1130
(doi: 10.1134/s0022476615060165)
Catenation and encapsulation induce distinct reconstitutions within a dynamic library of mixed-ligand Zn4L6 cages.
Chemical science
(2016)
7
2614
(doi: 10.1039/c5sc04906g)
Hamiltonian Dynamics of Protein Filament Formation.
Phys Rev Lett
(2016)
116
038101
De Novo Evolutionary Emergence of a Symmetrical Protein Is Shaped by Folding Constraints.
Cell
(2016)
164
476
(doi: 10.1016/j.cell.2015.12.024)
The total synthesis of K-252c (staurosporinone) via a sequential C-H functionalisation strategy
Chemical science
(2016)
7
2706
(doi: 10.1039/c5sc04399a)
Seeding approach to crystal nucleation.
The Journal of Chemical Physics
(2016)
144
034501
(doi: 10.1063/1.4939641)
ChemInform Abstract: Hypervalent Iodine(III) in Direct Oxidative Amination of Arenes with Heteroaromatic Amines.
ChemInform
(2016)
47
no
(doi: 10.1002/chin.201606105)
Connecting defects and amorphization in UiO-66 and MIL-140 metal–organic frameworks: a combined experimental and computational study.
Phys Chem Chem Phys
(2016)
18
2192
(doi: 10.1039/c5cp06798g)
Beneficial effects of substituting trivalent ions in the B-site of La 0.5 Sr 0.5 Mn 1−x A x O 3 (A = Al, Ga, Sc) on the thermochemical generation of CO and H 2 from CO 2 and H 2 O
Dalton transactions (Cambridge, England : 2003)
(2016)
45
2430
(doi: 10.1039/c5dt04822b)