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- Currently displaying 10041 - 10060 of 29303 publications
An unusual coordination polymer containing Cu+ ions and featuring possible Cu•••Cu 'cuprophilic' interactions: poly[di-μ-chlorido-(μ4-3,5-diaminobenzoato-κ4O:O′:N:N′)tricopper(I)(3 Cu-Cu)]
Acta Crystallographica Section C: Structural Chemistry
(2016)
72
63
(doi: 10.1107/S205322961502330X)
Numerical modelling strategies for the urban atmosphere: general discussion
Faraday Discussions
(2016)
189
635
(doi: 10.1039/C6FD90022D)
Toward the suppression of cellular toxicity from single-walled carbon nanotubes
Biomater Sci
(2016)
4
230
(doi: 10.1039/c5bm00134j)
Catalyst nanoparticle growth dynamics and their influence on product morphology in a CVD process for continuous carbon nanotube synthesis
Carbon
(2016)
96
116
(doi: 10.1016/j.carbon.2015.09.050)
Metainference: A Bayesian inference method for heterogeneous systems
Science advances
(2016)
2
e1501177
(doi: 10.1126/sciadv.1501177)
Stochastic quantum chemistry for strong correlation
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2016)
251
Energy transfer in pendant perylene diimide copolymers
Journal of Materials Chemistry C
(2016)
4
8270
(doi: 10.1039/c6tc02555b)
Non-adiabatic reactions: General discussion
Faraday Discussions
(2016)
195
311
(doi: 10.1039/c6fd90078j)
Nano-MoO3-mediated synthesis of bioactive thiazolidin-4-ones acting as anti-bacterial agents and their mode-of-action analysis using in silico target prediction, docking and similarity searching
New Journal of Chemistry
(2016)
40
2189
(doi: 10.1039/c5nj02729b)
On the predictability of supramolecular interactions in molecular cocrystals - the view from the bench
Crystengcomm
(2016)
18
5434
(doi: 10.1039/c6ce00293e)
Modelling the local atomic structure of molybdenum in nuclear waste glasses with ab initio molecular dynamics simulations
Physical Chemistry Chemical Physics
(2016)
18
26125
(doi: 10.1039/c6cp03076a)
Nanotechnology to rescue bacterial bidirectional extracellular electron transfer in bioelectrochemical systems
RSC Advances
(2016)
6
30582
(doi: 10.1039/c6ra04734c)
QTAIM and Stress Tensor Interpretation of the (H2O)5 Potential Energy Surface
JOURNAL OF COMPUTATIONAL CHEMISTRY
(2016)
37
2712
(doi: 10.1002/jcc.24498)
Understanding cytotoxicity in high-throughput screening collections using an in silico polypharmacological prediction protocol
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2016)
252
Comparison of surface techniques for the discrimination of polymorphs
Crystengcomm
(2016)
18
5296
(doi: 10.1039/c6ce01096b)
Chapter Two Thermodynamic Effective Molarities for Supramolecular Complexes
(2016)
50
77
(doi: 10.1016/bs.apoc.2016.07.001)