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