Marek J. Wójcik - Search Results

Year	Number of Results
2005	1
2006	3
2007	1
2008	1
2009	1
2011	2
2012	1
2014	1
2015	2
2016	3
2017	4
2018	4
2019	3
2020	1
2021	1

1

A comparison of the hydrogen bond interaction dynamics in the adenine and thymine crystals: BOMD and spectroscopic study.

Brela MZ, Klimas O, Boczar M, Nakajima T, Wójcik MJ. Brela MZ, et al. Among authors: wojcik mj. Spectrochim Acta A Mol Biomol Spectrosc. 2020 Aug 15;237:118398. doi: 10.1016/j.saa.2020.118398. Epub 2020 Apr 22. Spectrochim Acta A Mol Biomol Spectrosc. 2020. PMID: 32361519 Free article.

2

Theoretical Study of Proton Tunneling in the Imidazole-Imidazolium Complex.

Boda Ł, Boczar M, Wójcik MJ, Nakajima T. Boda Ł, et al. Among authors: wojcik mj. J Phys Chem A. 2021 Aug 19;125(32):6902-6912. doi: 10.1021/acs.jpca.1c02972. Epub 2021 Aug 5. J Phys Chem A. 2021. PMID: 34350765 Free PMC article.

3

IR Spectra of Crystalline Nucleobases: Combination of Periodic Harmonic Calculations with Anharmonic Corrections Based on Finite Models.

Beć KB, Grabska J, Czarnecki MA, Huck CW, Wójcik MJ, Nakajima T, Ozaki Y. Beć KB, et al. Among authors: wojcik mj. J Phys Chem B. 2019 Nov 27;123(47):10001-10013. doi: 10.1021/acs.jpcb.9b06285. Epub 2019 Nov 13. J Phys Chem B. 2019. PMID: 31687819

4

Spectroscopic study of uracil, 1-methyluracil and 1-methyl-4-thiouracil: Hydrogen bond interactions in crystals and ab-initio molecular dynamics.

Brela MZ, Boczar M, Malec LM, Wójcik MJ, Nakajima T. Brela MZ, et al. Among authors: wojcik mj. Spectrochim Acta A Mol Biomol Spectrosc. 2018 May 15;197:194-201. doi: 10.1016/j.saa.2018.01.050. Epub 2018 Jan 31. Spectrochim Acta A Mol Biomol Spectrosc. 2018. PMID: 29395929

5

Correlations between Structure and Near-Infrared Spectra of Saturated and Unsaturated Carboxylic Acids. Insight from Anharmonic Density Functional Theory Calculations.

Grabska J, Ishigaki M, Beć KB, Wójcik MJ, Ozaki Y. Grabska J, et al. Among authors: wojcik mj. J Phys Chem A. 2017 May 11;121(18):3437-3451. doi: 10.1021/acs.jpca.7b02053. Epub 2017 Apr 28. J Phys Chem A. 2017. PMID: 28414469

6

Spectra-structure correlations of saturated and unsaturated medium-chain fatty acids. Near-infrared and anharmonic DFT study of hexanoic acid and sorbic acid.

Grabska J, Beć KB, Ishigaki M, Wójcik MJ, Ozaki Y. Grabska J, et al. Among authors: wojcik mj. Spectrochim Acta A Mol Biomol Spectrosc. 2017 Oct 5;185:35-44. doi: 10.1016/j.saa.2017.05.024. Epub 2017 May 13. Spectrochim Acta A Mol Biomol Spectrosc. 2017. PMID: 28535459

7

Theoretical modeling of infrared spectra of hydrogen-bonded crystals of salicylic acid.

Boczar M, Boda L, Wójcik MJ. Boczar M, et al. Among authors: wojcik mj. Spectrochim Acta A Mol Biomol Spectrosc. 2006 Jun;64(3):757-60. doi: 10.1016/j.saa.2005.06.049. Epub 2006 Jan 18. Spectrochim Acta A Mol Biomol Spectrosc. 2006. PMID: 16387543

8

Towards accurate infrared spectral density of weak H-bonds in absence of relaxation mechanisms.

Rekik N, Salman S, Farooq U, Nakajima T, Wojcik MJ, Blaise P. Rekik N, et al. Among authors: wojcik mj. Spectrochim Acta A Mol Biomol Spectrosc. 2019 Jan 15;207:197-208. doi: 10.1016/j.saa.2018.09.003. Epub 2018 Sep 6. Spectrochim Acta A Mol Biomol Spectrosc. 2019. PMID: 30240981

9

Spectroscopic and Computational Study of Acetic Acid and Its Cyclic Dimer in the Near-Infrared Region.

Beć KB, Futami Y, Wójcik MJ, Nakajima T, Ozaki Y. Beć KB, et al. Among authors: wojcik mj. J Phys Chem A. 2016 Aug 11;120(31):6170-83. doi: 10.1021/acs.jpca.6b04470. Epub 2016 Aug 2. J Phys Chem A. 2016. PMID: 27482762

10

Equivalence between the Classical and Quantum IR Spectral Density Approaches of Weak H-Bonds in the Absence of Damping.

Rekik N, Suleiman J, Blaise P, Wojcik MJ. Rekik N, et al. Among authors: wojcik mj. J Phys Chem A. 2018 Mar 1;122(8):2108-2115. doi: 10.1021/acs.jpca.8b00269. Epub 2018 Feb 20. J Phys Chem A. 2018. PMID: 29436830

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