Matsui T - Search Results

1

Theoretical study on reaction scheme of silver(I) containing 5-substituted uracils bridge formation.

Matsui T, Miyachi H, Baba T, Shigeta Y. Matsui T, et al. J Phys Chem A. 2011 Aug 4;115(30):8504-10. doi: 10.1021/jp200871f. Epub 2011 Jul 8. J Phys Chem A. 2011. PMID: 21688824

2

Multiple proton-transfer reactions in DNA base pairs by coordination of pt complex.

Matsui T, Shigeta Y, Hirao K. Matsui T, et al. J Phys Chem B. 2007 Feb 8;111(5):1176-81. doi: 10.1021/jp065727+. J Phys Chem B. 2007. PMID: 17266272

3

Metal-assisted proton transfer reaction in base pairs.

Matsui T, Shigeta Y, Hirao K. Matsui T, et al. Nucleic Acids Symp Ser (Oxf). 2007;(51):225-6. doi: 10.1093/nass/nrm113. Nucleic Acids Symp Ser (Oxf). 2007. PMID: 18029668

4

Structural origin of copper ion containing artificial DNA: a density functional study.

Matsui T, Miyachi H, Sato T, Shigeta Y, Hirao K. Matsui T, et al. J Phys Chem B. 2008 Dec 25;112(51):16960-5. doi: 10.1021/jp8080707. J Phys Chem B. 2008. PMID: 19367866

5

Theoretical studies on sulfur and metal cation (Cu(II), Ni(II), Pd(II), and Pt(II))-containing artificial DNA.

Matsui T, Miyachi H, Nakanishi Y, Shigeta Y, Sato T, Kitagawa Y, Okumura M, Hirao K. Matsui T, et al. J Phys Chem B. 2009 Sep 24;113(38):12790-5. doi: 10.1021/jp9045319. J Phys Chem B. 2009. PMID: 19708672

6

Electronic structure and UV absorption spectra of metal-mediate DNA: an approach from theoretical chemistry.

Matsui T, Miyachi H, Nakanishi Y, Shigeta Y, Kitagawa Y, Okumura M, Hirao K. Matsui T, et al. Nucleic Acids Symp Ser (Oxf). 2009;(53):181-2. doi: 10.1093/nass/nrp091. Nucleic Acids Symp Ser (Oxf). 2009. PMID: 19749320

7

Spin contamination error in optimized geometry of singlet carbene ((1)A1) by broken-symmetry method.

Kitagawa Y, Saito T, Nakanishi Y, Kataoka Y, Matsui T, Kawakami T, Okumura M, Yamaguchi K. Kitagawa Y, et al. Among authors: matsui t. J Phys Chem A. 2009 Dec 31;113(52):15041-6. doi: 10.1021/jp905125g. J Phys Chem A. 2009. PMID: 19817370

8

Effects of mercury(II) on structural properties, electronic structure and UV absorption spectra of a duplex containing thymine-mercury(II)-thymine nucleobase pairs.

Miyachi H, Matsui T, Shigeta Y, Hirao K. Miyachi H, et al. Among authors: matsui t. Phys Chem Chem Phys. 2010 Jan 28;12(4):909-17. doi: 10.1039/b912807g. Epub 2009 Dec 7. Phys Chem Chem Phys. 2010. PMID: 20066376

9

Theoretical insight into stereoselective reaction mechanisms of 2,4-pentanediol-tethered ketene-olefin [2 + 2] cycloaddition.

Kamiya K, Matsui T, Sugimura T, Shigeta Y. Kamiya K, et al. Among authors: matsui t. J Phys Chem A. 2012 Feb 2;116(4):1168-75. doi: 10.1021/jp211542m. Epub 2012 Jan 23. J Phys Chem A. 2012. PMID: 22220552

10

An accurate density functional theory based estimation of pK(a) values of polar residues combined with experimental data: from amino acids to minimal proteins.

Matsui T, Baba T, Kamiya K, Shigeta Y. Matsui T, et al. Phys Chem Chem Phys. 2012 Mar 28;14(12):4181-7. doi: 10.1039/c2cp23069k. Epub 2012 Feb 15. Phys Chem Chem Phys. 2012. PMID: 22337283

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