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