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1
artikkel ajakirjas EST
/
artikkel ajakirjas ENG
Reaction path scans : Aza-Michael reactions of isatin imines
Metsala, Andrus
;
Žari, Sergei
;
Kanger, Tõnis
Computational and theoretical chemistry
2017
/
p. 30-40 : ill
https://doi.org/10.1016/j.comptc.2017.07.014
Journal metrics at Scopus
Article at Scopus
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Article at WOS
artikkel ajakirjas EST
/
artikkel ajakirjas ENG
2
artikkel ajakirjas EST
/
artikkel ajakirjas ENG
Shortfall of B3LYP in reproducing NMR JCH couplings in some isomeric epoxy structures with strong stereoelectronic effects : a benchmark study on DFT functionals
Adamson, Jasper
;
Nazarski, Ryszard B.
;
Jarvet, Jüri
;
Pehk, Tõnis
;
Aav, Riina
ChemPhysChem
2018
/
p. 631-642 : ill
https://doi.org/10.1002/cphc.201701125
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artikkel ajakirjas EST
/
artikkel ajakirjas ENG
Kirjeid leitud 2, kuvan
1 - 2
võtmesõna
443
1.
conformational analysis
2.
conformational analyses
3.
conformational design
4.
conformational rigidity
5.
conformational study
6.
conformational switching
7.
ABC analysis
8.
AC analysis
9.
accuracy analysis
10.
acoustic analysis
11.
acoustic signal analysis
12.
activation analysis
13.
algebraic analysis
14.
amino acids analysis
15.
analysis
16.
analysis costs
17.
analysis methods
18.
analysis model
19.
analysis patterns
20.
analysis software
21.
analysis structuring
22.
analytical analysis
23.
analytical flow network analysis
24.
application analysis
25.
audio signal analysis
26.
autocorrelation analysis
27.
bandwidth analysis
28.
banking analysis
29.
barrier analysis
30.
benchmark analysis
31.
bibliometric analysis
32.
big data analysis
33.
big graph analysis
34.
Biochemical analysis
35.
bioelectrical impedance analysis
36.
bioinformatic analysis
37.
biomass composition analysis
38.
break-even analysis
39.
Buckling analysis
40.
business analysis
41.
business process analysis
42.
C. Numerical analysis
43.
cache vulnerability analysis
44.
calculation analysis
45.
case analysis methodology
46.
cash flow analysis
47.
cash-based analysis
48.
Choice-Based Conjoint analysis
49.
circuit analysis
50.
citation analysis
51.
climate analysis
52.
cluster analysis
53.
clustering analysis
54.
CO2 concentration analysis
55.
co-citation analysis
56.
comparative analysis
57.
competition analysis
58.
component dependency analysis
59.
Computational Fluid Dynamics (CFD) analysis
60.
conceptual framework for safety/risk analysis
61.
content analysis
62.
control system analysis
63.
Convergence analysis
64.
correlation analysis
65.
Cost & benefit analysis
66.
cost analysis
67.
cost benefit analysis
68.
cost efficiency analysis
69.
cost-benefit analysis
70.
cost-effectiveness analysis
71.
costing analysis cataloging processes
72.
country analysis model
73.
coupled and decoupled analysis
74.
co-word analysis
75.
critical disclosure analysis
76.
cross-lagged analysis
77.
cross-language analysis
78.
cryoelectron microscopy single-particle analysis
79.
curricula content analysis
80.
dairy product analysis
81.
data analysis
82.
data envelopment analysis
83.
defect and failure analysis
84.
dependency analysis
85.
descriptive sensory analysis
86.
determinacy analysis
87.
detrended fluctuation analysis (DFA)
88.
deviation analysis
89.
DFM analysis
90.
Differential Power Analysis (DPA)
91.
differential thermal analysis (DTA)
92.
digital image analysis
93.
discrete analysis
94.
discrete spectral analysis
95.
discriminant analysis
96.
dispersion analysis
97.
domain analysis
98.
domain analysis and engineering
99.
donor behavior analysis
100.
droplet analysis
101.
droplet digital image analysis
102.
DuPont analysis
103.
dynamic analysis
104.
dynamic handwriting analysis
105.
EBSD analysis
106.
economic analysis
107.
Economic growth and aggregate productivity regional government analysis
108.
EEG analysis
109.
efficiency analysis
110.
efficiency map analysis
111.
Eigenvalue analysis
112.
electric machine analysis computing
113.
electric network analysis
114.
electromagnetic analysis
115.
electron backscattered diffraction analysis
116.
elemental analysis
117.
ELF Binary Analysis
118.
empirical analysis
119.
energy system analysis
120.
Enrichment analysis
121.
enterprise analysis model (EAM)
122.
enterprise data analysis
123.
environmental analysis
124.
EOF analysis
125.
epistemological analysis
126.
error analysis
127.
event log analysis
128.
evolved gas analysis
129.
Evolved gas analysis (EGA)
130.
ex post analysis
131.
experimental analysis
132.
experimental modal analysis
133.
explicit analysis
134.
exploratory analysis
135.
exploratory data analysis
136.
factor analysis
137.
failure analysis
138.
Failure mode and effect analysis (FMEA)
139.
failure modes and effect analysis
140.
fast independent component analysis
141.
fault analysis
142.
fault analysis model
143.
fault tree analysis
144.
FEA analysis
145.
feasibility analysis
146.
feature analysis
147.
FEM analysis
148.
financial statement analysis
149.
fingerprint analysis
150.
finite element (FE) analysis
151.
finite element analysis
152.
finite element analysis (FEA)
153.
finite-element (FE) analysis
154.
finite-element analysis
155.
flow analysis
156.
flow network analysis
157.
Flux balance analysis
158.
flux balance analysis biotechnological processes
159.
food analysis
160.
forensic analysis
161.
forensic soil analysis
162.
formal concept analysis
163.
Fourier analysis
164.
fractal analysis
165.
framing analysis
166.
free vibration analysis
167.
frequency analysis
168.
frequency domain analysis
169.
frequency response analysis
170.
frequency-domain analysis
171.
functional data analysis
172.
functional gene analysis
173.
functional institutional analysis
174.
fuzzy set qualitative comparative analysis (fsQCA)
175.
Fuzzy-Set Qualitative comparative analysis
176.
gait analysis
177.
gap analysis
178.
gate-level analysis
179.
GC/MS analysis
180.
genome-wide analysis
181.
geospatial analysis
182.
girder analysis
183.
GIS analysis
184.
grading analysis
185.
grain-size analysis
186.
grounding damage analysis
187.
harmonic analysis
188.
hierarchical cluster analysis (statistics)
189.
hierarchical timing analysis
190.
hierarchical two-level analysis
191.
high-speed thermogravimetric analysis
192.
high-temperature differential thermal analysis (HDTA)
193.
high-throughput analysis
194.
identity structure analysis
195.
Identity Structure Analysis (ISA)
196.
image analysis
197.
impact analysis
198.
index number analysis
199.
information analysis
200.
innovative support analysis
201.
input-output analysis
202.
institutional analysis
203.
integrated system of performance analysis
204.
international comparative analysis
205.
intsitutional analysis
206.
investment analysis
207.
investment impact analysis
208.
isogeometric analysis
209.
kinetic analysis
210.
Lagrangian analysis
211.
landscape analysis
212.
learning analysis
213.
life cycle analysis
214.
life cycle analysis (LCA)
215.
life cycle cost analysis (LCCA)
216.
lifetime analysis
217.
linguistic analysis
218.
link analysis
219.
literature analysis
220.
lithofacies analysis
221.
load-bearing analysis
222.
log file analysis
223.
logical analysis
224.
logico-phaneroscopical analysis
225.
long-term performance analysis
226.
Lyapunov analysis
227.
machinery utilization analysis
228.
macroeconomic analysis
229.
macrofossil analysis
230.
MALDI-TOF mass spectrometry analysis
231.
malware analysis
232.
map analysis
233.
market analysis
234.
market basket analysis
235.
mass analysis
236.
Material flow analysis
237.
materials computational analysis
238.
mathematical analysis
239.
matrix analysis
240.
mediation analysis
241.
melissopalynological analysis
242.
meta-analysis
243.
metabolic control analysis
244.
metabolic flux analysis
245.
metabolic pathways analysis
246.
metagenetic analysis
247.
metagenome analysis
248.
Metagenomic analysis
249.
metallographic analysis
250.
metaphors in analysis
251.
meta-regression analysis
252.
method of analysis
253.
method of signature analysis of outgoing traffic
254.
methods: data analysis
255.
MICMAC analysis
256.
microarray analysis
257.
microfacies analysis
258.
microscope analysis
259.
microscopy image analysis
260.
microstructural analysis
261.
milk analysis
262.
mixing analysis
263.
modal analysis
264.
Module Analysis
265.
Monetary policy analysis
266.
Monte Carlo analysis
267.
motion analysis
268.
motor current signature analysis
269.
multi scale analysis
270.
multi-country analysis
271.
multicriteria analysis
272.
multi-criteria analysis
273.
Multi-criteria decision analysis
274.
multi-criteria-analysis
275.
multifractal analysis
276.
multiphysics analysis
277.
Multiple criteria analysis
278.
multiple factorial analysis
279.
multivariate analysis
280.
multivariate data analysis
281.
mutation analysis
282.
network analysis
283.
noise analysis
284.
non-commutative complex analysis
285.
numerical analysis
286.
organic residue analysis
287.
package test analysis
288.
paper micro-zone analysis
289.
Pareto front analysis
290.
particle size analysis
291.
PCA analysis
292.
peptide analysis
293.
performance analysis
294.
performance analysis reconfigurable architectures
295.
PESTEL analysis
296.
phenotypic analysis
297.
phylogenetic analysis
298.
pollen analysis
299.
popularity analysis
300.
post-analysis of rules
301.
Power Mismatch Analysis
302.
power system analysis computing
303.
predictive analysis
304.
principal component analysis
305.
principal component analysis (PCA)
306.
profitability analysis
307.
program analysis
308.
pulse analysis
309.
pulse wave analysis
310.
pulse waveform analysis
311.
qualitative analysis
312.
qualitative and quantitative analysis
313.
qualitative comparison analysis
314.
quantitative analysis
315.
quantitative chemical analysis
316.
quantitative metal analysis
317.
quantitative risk analysis
318.
quantitative XRD analysis
319.
quasi steady state (QSS) analysis
320.
quasi-static analysis
321.
Raman analysis
322.
ramp behavior analysis
323.
ramping behaviour analysis
324.
ratio analysis
325.
Real-time Analysis
326.
regression analysis
327.
Regression tree analysis
328.
reliability analysis
329.
risk analysis
330.
risk preference analysis
331.
robot-cell performance analysis
332.
robust stability analysis
333.
robustness analysis
334.
RTL analysis
335.
scenario analysis
336.
security analysis
337.
security log analysis
338.
self-analysis
339.
SEM analysis
340.
SEM-analysis
341.
sensitivity analysis
342.
Sensors modeling and analysis
343.
sensory analysis
344.
sentiment analysis
345.
signal analysis
346.
similarity analysis
347.
simulation analysis
348.
simulation and analysis
349.
Simultaneous thermogravimetry (TG) and differential thermal analysis (DTA)
350.
singular spectrum analysis (SSA)
351.
situational analysis
352.
sobol sensitivity analysis
353.
social network analysis
354.
social-economic analysis
355.
sociotechnical analysis
356.
spatial analysis
357.
spatial data analysis
358.
spectral analysis
359.
spectrogram analysis
360.
Spectrophotometric analysis
361.
spectrum analysis
362.
spore and pollen analysis
363.
stability analysis
364.
stable isotope analysis
365.
stakeholder analysis
366.
static analysis
367.
static timing analysis
368.
statistical analysis
369.
steady state analysis
370.
steady-state analysis
371.
steady‐state growth space analysis
372.
stedy-state analysis
373.
strength analysis
374.
string analysis
375.
structural analysis
376.
structural decomposition analysis
377.
structure computer analysis
378.
student data analysis
379.
suitability analysis
380.
surface wave analysis
381.
survival analysis
382.
SWOT analysis
383.
symbolic data analysis
384.
symmetry analysis
385.
synchronous reluctance motors thermal analysis
386.
system analysis
387.
system analysis and design
388.
system integrated analysis
389.
system-level analysis
390.
systems integrated analysis
391.
systems-theoretic process analysis (STPA)
392.
task analysis
393.
taste dilution analysis
394.
technical analysis
395.
technoeconomic analysis
396.
Techno-economic analysis
397.
technology analysis
398.
TEM and SEM analysis
399.
TEM-analysis
400.
term-frequency analysis
401.
testability analysis
402.
texture profile analysis
403.
the accuracy of monitoring in analysis of impact impulses
404.
thematic analysis
405.
thematic content analysis
406.
theoretical analysis
407.
thermal analysis
408.
thermal analysis tool
409.
thermodynamic analysis
410.
thermoeconomic analysis
411.
thermogravimetric analysis
412.
time analysis
413.
time domain analysis
414.
time series analysis
415.
timing analysis
416.
tolerance analysis
417.
topographic analysis
418.
training needs analysis
419.
Transdermal analysis patch
420.
transformer analysis
421.
transient analysis
422.
trend analysis
423.
uncertainty analysis
424.
urban analysis
425.
user click behaviour analysis
426.
value network analysis
427.
water analysis
428.
waveform analysis
429.
wavelet analysis
430.
weak signal analysis
431.
wear analysis
432.
western blot analysis
433.
vibrational analysis
434.
wind analysis
435.
visco-thermal analysis
436.
visits registration and statistical analysis
437.
work analysis
438.
X-ray analysis
439.
X-ray crystallographic analysis
440.
X-ray line-profile analysis
441.
XRD structure analysis
442.
XYZ analysis
443.
(computational fluid dynamics) CFD analysis
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