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Items: 1 to 50 of 164

1.

Corrigendum to "Zeaxanthin: Review of Toxicological Data and Acceptable Daily Intake".

Edwards JA, Cremer D.

J Ophthalmol. 2019 Jun 11;2019:6212745. doi: 10.1155/2019/6212745. eCollection 2019.

2.

Coping with noise in social dilemmas: Group representatives fare worse than individuals because they lack trust in others' benign intentions.

Reinders Folmer CP, Wildschut T, De Cremer D, van Lange PAM.

Group Process Intergroup Relat. 2019 Feb;22(2):200-214. doi: 10.1177/1368430217722036. Epub 2017 Aug 17.

3.

In Situ Measure of Intrinsic Bond Strength in Crystalline Structures: Local Vibrational Mode Theory for Periodic Systems.

Tao Y, Zou W, Sethio D, Verma N, Qiu Y, Tian C, Cremer D, Kraka E.

J Chem Theory Comput. 2019 Mar 12;15(3):1761-1776. doi: 10.1021/acs.jctc.8b01279. Epub 2019 Feb 28.

PMID:
30776228
4.

Pulmonary arterial hypertension in adult-onset Still's disease: A case series and systematic review of the literature.

Narváez J, Mora-Limiñana M, Ros I, Ibañez M, Valldeperas J, Crémer D, Nolla JM, Juan-Mas A.

Semin Arthritis Rheum. 2019 Aug;49(1):162-170. doi: 10.1016/j.semarthrit.2018.11.007. Epub 2018 Dec 4. Review.

PMID:
30580885
5.

So Gross and Yet so Far Away: Psychological Distance Moderates the Effect of Disgust on Moral Judgment.

van Dijke M, van Houwelingen G, De Cremer D, De Schutter L.

Soc Psychol Personal Sci. 2018 Aug;9(6):689-701. doi: 10.1177/1948550617722198. Epub 2017 Aug 16.

6.

From strong to weak NF bonds: on the design of a new class of fluorinating agents.

Setiawan D, Sethio D, Cremer D, Kraka E.

Phys Chem Chem Phys. 2018 Oct 7;20(37):23913-23927. doi: 10.1039/c8cp03843k. Epub 2018 Sep 12.

PMID:
30206587
7.

The trickle-down effects of perceived trustworthiness on subordinate performance.

De Cremer D, van Dijke M, Schminke M, De Schutter L, Stouten J.

J Appl Psychol. 2018 Dec;103(12):1335-1357. doi: 10.1037/apl0000339. Epub 2018 Jul 30.

PMID:
30058813
8.

Can education change the world? Education amplifies differences in liberalization values and innovation between developed and developing countries.

Van Hiel A, Van Assche J, De Cremer D, Onraet E, Bostyn D, Haesevoets T, Roets A.

PLoS One. 2018 Jun 21;13(6):e0199560. doi: 10.1371/journal.pone.0199560. eCollection 2018.

9.

Recovering Intrinsic Fragmental Vibrations Using the Generalized Subsystem Vibrational Analysis.

Tao Y, Tian C, Verma N, Zou W, Wang C, Cremer D, Kraka E.

J Chem Theory Comput. 2018 May 8;14(5):2558-2569. doi: 10.1021/acs.jctc.7b01171. Epub 2018 Apr 18.

PMID:
29634270
10.

Understanding the positive effect of financial compensation on trust after norm violations: Evidence from fMRI in favor of forgiveness.

Haesevoets T, De Cremer D, Van Hiel A, Van Overwalle F.

J Appl Psychol. 2018 May;103(5):578-590. doi: 10.1037/apl0000271. Epub 2017 Dec 18.

PMID:
29251949
11.

Correlating the vibrational spectra of structurally related molecules: A spectroscopic measure of similarity.

Tao Y, Zou W, Cremer D, Kraka E.

J Comput Chem. 2018 Mar 5;39(6):293-306. doi: 10.1002/jcc.25109. Epub 2017 Nov 16.

PMID:
29143968
12.

Motivated reasoning during recruitment.

Kappes HB, Balcetis E, De Cremer D.

J Appl Psychol. 2018 Mar;103(3):270-280. doi: 10.1037/apl0000263. Epub 2017 Oct 12.

PMID:
29022723
13.

Characterizing Chemical Similarity with Vibrational Spectroscopy: New Insights into the Substituent Effects in Monosubstituted Benzenes.

Tao Y, Zou W, Cremer D, Kraka E.

J Phys Chem A. 2017 Oct 26;121(42):8086-8096. doi: 10.1021/acs.jpca.7b08298. Epub 2017 Oct 16.

PMID:
28960072
14.

Ranking low, feeling high: How hierarchical position and experienced power promote prosocial behavior in response to procedural justice.

van Dijke M, De Cremer D, Langendijk G, Anderson C.

J Appl Psychol. 2018 Feb;103(2):164-181. doi: 10.1037/apl0000260. Epub 2017 Sep 21.

PMID:
28933910
15.

The Many Facets of Chalcogen Bonding: Described by Vibrational Spectroscopy.

Oliveira V, Cremer D, Kraka E.

J Phys Chem A. 2017 Sep 14;121(36):6845-6862. doi: 10.1021/acs.jpca.7b06479. Epub 2017 Aug 31.

PMID:
28782954
16.

When the Heat Is On: The Effect of Temperature on Voter Behavior in Presidential Elections.

Van Assche J, Van Hiel A, Stadeus J, Bushman BJ, De Cremer D, Roets A.

Front Psychol. 2017 Jun 8;8:929. doi: 10.3389/fpsyg.2017.00929. eCollection 2017.

17.

The Peculiar Role of the Au3 Unit in Aum Clusters: σ-Aromaticity of the Au5Zn+ Ion.

Li Y, Oliveira V, Tang C, Cremer D, Liu C, Ma J.

Inorg Chem. 2017 May 15;56(10):5793-5803. doi: 10.1021/acs.inorgchem.7b00404. Epub 2017 Apr 27.

PMID:
28448130
18.

Calculations of atomic magnetic nuclear shielding constants based on the two-component normalized elimination of the small component method.

Yoshizawa T, Zou W, Cremer D.

J Chem Phys. 2017 Apr 7;146(13):134109. doi: 10.1063/1.4979499.

PMID:
28390341
19.
20.

Oesophageal heat exchangers with a diameter of 11mm or 14.7mm are equally effective and safe for targeted temperature management.

Schroeder DC, Guschlbauer M, Maul AC, Cremer DA, Becker I, de la Puente Bethencourt D, Paal P, Padosch SA, Wetsch WA, Annecke T, Böttiger BW, Sterner-Kock A, Herff H.

PLoS One. 2017 Mar 14;12(3):e0173229. doi: 10.1371/journal.pone.0173229. eCollection 2017.

21.

Different Ways of Hydrogen Bonding in Water - Why Does Warm Water Freeze Faster than Cold Water?

Tao Y, Zou W, Jia J, Li W, Cremer D.

J Chem Theory Comput. 2017 Jan 10;13(1):55-76. doi: 10.1021/acs.jctc.6b00735. Epub 2016 Dec 20.

PMID:
27996255
22.

Quantitative Assessment of Halogen Bonding Utilizing Vibrational Spectroscopy.

Oliveira V, Kraka E, Cremer D.

Inorg Chem. 2017 Jan 3;56(1):488-502. doi: 10.1021/acs.inorgchem.6b02358. Epub 2016 Dec 14.

PMID:
27966937
23.

The intrinsic strength of the halogen bond: electrostatic and covalent contributions described by coupled cluster theory.

Oliveira V, Kraka E, Cremer D.

Phys Chem Chem Phys. 2016 Dec 7;18(48):33031-33046.

PMID:
27886325
25.

A Reaction Valley Investigation of the Cycloaddition of 1,3-Dipoles with the Dipolarophiles Ethene and Acetylene: Solution of a Mechanistic Puzzle.

Sexton TM, Freindorf M, Kraka E, Cremer D.

J Phys Chem A. 2016 Oct 27;120(42):8400-8418. doi: 10.1021/acs.jpca.6b07975. Epub 2016 Oct 18.

PMID:
27690469
26.

Quantitative Assessment of Aromaticity and Antiaromaticity Utilizing Vibrational Spectroscopy.

Setiawan D, Kraka E, Cremer D.

J Org Chem. 2016 Oct 21;81(20):9669-9686. Epub 2016 Sep 28.

PMID:
27635783
27.

Rational Design in Catalysis: A Mechanistic Study of β-Hydride Eliminations in Gold(I) and Gold(III) Complexes Based on Features of the Reaction Valley.

Castiñeira Reis M, López CS, Kraka E, Cremer D, Faza ON.

Inorg Chem. 2016 Sep 6;55(17):8636-45. doi: 10.1021/acs.inorgchem.6b01188. Epub 2016 Aug 18.

PMID:
27537214
28.

Correction to Direct Measure of Metal-Ligand Bonding Replacing the Tolman Electronic Parameter.

Setiawan D, Kalescky R, Kraka E, Cremer D.

Inorg Chem. 2016 Apr 4;55(7):3713. doi: 10.1021/acs.inorgchem.6b00665. Epub 2016 Mar 23. No abstract available.

PMID:
27008470
29.

B-H···π Interaction: A New Type of Nonclassical Hydrogen Bonding.

Zhang X, Dai H, Yan H, Zou W, Cremer D.

J Am Chem Soc. 2016 Apr 6;138(13):4334-7. doi: 10.1021/jacs.6b01249. Epub 2016 Feb 29.

PMID:
26910602
30.

Direct Measure of Metal-Ligand Bonding Replacing the Tolman Electronic Parameter.

Setiawan D, Kalescky R, Kraka E, Cremer D.

Inorg Chem. 2016 Mar 7;55(5):2332-44. doi: 10.1021/acs.inorgchem.5b02711. Epub 2016 Feb 22. Erratum in: Inorg Chem. 2016 Apr 4;55(7):3713.

PMID:
26900632
31.

Extraordinary Mechanism of the Diels-Alder Reaction: Investigation of Stereochemistry, Charge Transfer, Charge Polarization, and Biradicaloid Formation.

Sexton T, Kraka E, Cremer D.

J Phys Chem A. 2016 Feb 25;120(7):1097-111. doi: 10.1021/acs.jpca.5b11493. Epub 2016 Feb 16.

PMID:
26785172
32.

C2 in a Box: Determining Its Intrinsic Bond Strength for the X(1)Σg(+) Ground State.

Zou W, Cremer D.

Chemistry. 2016 Mar 14;22(12):4087-99. doi: 10.1002/chem.201503750. Epub 2016 Jan 7.

PMID:
26742466
33.

A New Method for Describing the Mechanism of a Chemical Reaction Based on the Unified Reaction Valley Approach.

Zou W, Sexton T, Kraka E, Freindorf M, Cremer D.

J Chem Theory Comput. 2016 Feb 9;12(2):650-63. doi: 10.1021/acs.jctc.5b01098. Epub 2016 Jan 26.

PMID:
26734810
34.

Solving the Pericyclic-Pseudopericyclic Puzzle in the Ring-Closure Reactions of 1,2,4,6-Heptatetraene Derivatives.

López CS, Faza ON, Freindorf M, Kraka E, Cremer D.

J Org Chem. 2016 Jan 15;81(2):404-14. doi: 10.1021/acs.joc.5b01997. Epub 2015 Dec 28.

PMID:
26651473
35.

Re-evaluation of the bond length-bond strength rule: The stronger bond is not always the shorter bond.

Kraka E, Setiawan D, Cremer D.

J Comput Chem. 2016 Jan 5;37(1):130-42. doi: 10.1002/jcc.24207. Epub 2015 Oct 29.

PMID:
26515027
36.

Rejection in Bargaining Situations: An Event-Related Potential Study in Adolescents and Adults.

Zanolie K, de Cremer D, Güroğlu B, Crone EA.

PLoS One. 2015 Oct 7;10(10):e0139953. doi: 10.1371/journal.pone.0139953. eCollection 2015.

37.

Phenotypic Patterns of Cardiomyopathy Caused by Mutations in the Desmin Gene. A Clinical and Genetic Study in Two Inherited Heart Disease Units.

Ripoll-Vera T, Zorio E, Gámez JM, Molina P, Govea N, Crémer D.

Rev Esp Cardiol (Engl Ed). 2015 Nov;68(11):1027-9. doi: 10.1016/j.rec.2015.07.007. Epub 2015 Oct 1. No abstract available.

PMID:
26431784
38.

Hidden Bond Anomalies: The Peculiar Case of the Fluorinated Amine Chalcogenides.

Setiawan D, Kraka E, Cremer D.

J Phys Chem A. 2015 Sep 10;119(36):9541-56. doi: 10.1021/acs.jpca.5b05157. Epub 2015 Aug 26.

PMID:
26280987
39.

Analytical energy gradient for the two-component normalized elimination of the small component method.

Zou W, Filatov M, Cremer D.

J Chem Phys. 2015 Jun 7;142(21):214106. doi: 10.1063/1.4921915.

PMID:
26049478
40.

Out of control!? How loss of self-control influences prosocial behavior: the role of power and moral values.

Joosten A, van Dijke M, Van Hiel A, De Cremer D.

PLoS One. 2015 May 29;10(5):e0126377. doi: 10.1371/journal.pone.0126377. eCollection 2015.

41.

Preface: 25th Austin Symposium on Molecular Structure and Dynamics.

Cremer D, Kraka E.

J Phys Chem A. 2015 Mar 5;119(9):1443-5. doi: 10.1021/jp512702z. No abstract available.

PMID:
25739644
42.

Trust in decision-making authorities dictates the form of the interactive relationship between outcome fairness and procedural fairness.

Bianchi EC, Brockner J, van den Bos K, Seifert M, Moon H, van Dijke M, De Cremer D.

Pers Soc Psychol Bull. 2015 Jan;41(1):19-34. doi: 10.1177/0146167214556237. Epub 2014 Nov 11.

PMID:
25387762
43.

11,11-dimethyl-1,6-methano[10]annulene--an annulene with an ultralong CC bond or a fluxional molecule?

Humason A, Zou W, Cremer D.

J Phys Chem A. 2015 Mar 5;119(9):1666-82. doi: 10.1021/jp5082966. Epub 2014 Nov 10.

PMID:
25333314
44.

Strength of the pnicogen bond in complexes involving group Va elements N, P, and As.

Setiawan D, Kraka E, Cremer D.

J Phys Chem A. 2015 Mar 5;119(9):1642-56. doi: 10.1021/jp508270g. Epub 2014 Nov 7.

PMID:
25325889
45.

Pseudorotational landscape of seven-membered rings: the most stable chair and twist-boat conformers of ε-caprolactone.

Jahn MK, Dewald DA, Vallejo-López M, Cocinero EJ, Lesarri A, Zou W, Cremer D, Grabow JU.

Chemistry. 2014 Oct 20;20(43):14084-9. doi: 10.1002/chem.201403379. Epub 2014 Sep 5.

PMID:
25196306
46.

Removal of selenite from water using a synthetic dithiolate: an experimental and quantum chemical investigation.

Burriss D, Zou W, Cremer D, Walrod J, Atwood D.

Inorg Chem. 2014 Apr 21;53(8):4010-21. doi: 10.1021/ic402909t. Epub 2014 Apr 2.

PMID:
24694110
47.

Accurate determination of the binding energy of the formic acid dimer: the importance of geometry relaxation.

Kalescky R, Kraka E, Cremer D.

J Chem Phys. 2014 Feb 28;140(8):084315. doi: 10.1063/1.4866696.

PMID:
24588177
48.

Quantitative assessment of the multiplicity of carbon-halogen bonds: carbenium and halonium ions with F, Cl, Br, and I.

Kalescky R, Zou W, Kraka E, Cremer D.

J Phys Chem A. 2014 Mar 13;118(10):1948-63. doi: 10.1021/jp4120628. Epub 2014 Mar 4.

PMID:
24555526
49.

New approach to Tolman's electronic parameter based on local vibrational modes.

Kalescky R, Kraka E, Cremer D.

Inorg Chem. 2014 Jan 6;53(1):478-95. doi: 10.1021/ic4024663. Epub 2013 Dec 10.

PMID:
24320732
50.

Description of aromaticity with the help of vibrational spectroscopy: anthracene and phenanthrene.

Kalescky R, Kraka E, Cremer D.

J Phys Chem A. 2014 Jan 9;118(1):223-37. doi: 10.1021/jp4092514. Epub 2013 Dec 24.

PMID:
24308602

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