Sahu PK - Search Results

1

Protocol for rational design of covalently interacting inhibitors.

Schmidt TC, Welker A, Rieger M, Sahu PK, Sotriffer CA, Schirmeister T, Engels B. Schmidt TC, et al. Among authors: sahu pk. Chemphyschem. 2014 Oct 20;15(15):3226-35. doi: 10.1002/cphc.201402542. Epub 2014 Sep 24. Chemphyschem. 2014. PMID: 25251382

2

Interaction of serotonin and fluoxetine: toward understanding the importance of the chirality of fluoxetine (S form and R form).

Sahu PK, Wang CH, Lee SL. Sahu PK, et al. J Phys Chem B. 2009 Oct 29;113(43):14529-35. doi: 10.1021/jp907151n. J Phys Chem B. 2009. PMID: 19788198

3

Interaction of adenine adducts with thymine: a computational study.

Sahu PK, Kuo CW, Lee SL. Sahu PK, et al. J Phys Chem B. 2007 Mar 22;111(11):2991-8. doi: 10.1021/jp066856t. Epub 2007 Feb 28. J Phys Chem B. 2007. PMID: 17388410

4

Quantum mechanical calculations for the misincorporation of nucleotides opposite mutagenic 3,N4-ethenocytosine.

Srinivasadesikan V, Sahu PK, Lee SL. Srinivasadesikan V, et al. Among authors: sahu pk. J Phys Chem B. 2012 Sep 13;116(36):11173-9. doi: 10.1021/jp307239x. Epub 2012 Aug 31. J Phys Chem B. 2012. PMID: 22889303

5

A density functional theory study for the hydrogen-bonded nucleic acid base pair: cytosine dimer.

Sahu PK, Mishra RK, Lee SL. Sahu PK, et al. J Phys Chem A. 2005 Mar 31;109(12):2887-93. doi: 10.1021/jp0459965. J Phys Chem A. 2005. PMID: 16833606

6

Effect of microsolvation on zwitterionic glycine: an ab initio and density functional theory study.

Sahu PK, Lee SL. Sahu PK, et al. J Mol Model. 2008 May;14(5):385-92. doi: 10.1007/s00894-008-0282-3. Epub 2008 Mar 11. J Mol Model. 2008. PMID: 18330603

7

Model calculations for the misincorporation of nucleotides opposite five-membered exocyclic DNA adduct: N(2),3-ethenoguanine.

Srinivasadesikan V, Sahu PK, Lee SL. Srinivasadesikan V, et al. Among authors: sahu pk. J Phys Chem B. 2011 Sep 8;115(35):10537-46. doi: 10.1021/jp202738v. Epub 2011 Aug 11. J Phys Chem B. 2011. PMID: 21776999

8

Many-body interaction in glycine-(water)3 complex using density functional theory method.

Chaudhari A, Sahu PK, Lee SL. Chaudhari A, et al. Among authors: sahu pk. J Chem Phys. 2004 Jan 1;120(1):170-4. doi: 10.1063/1.1630019. J Chem Phys. 2004. PMID: 15267274

9

Spectroscopic probe on N-H⋯N, N-H⋯O and controversial C-H⋯O contact in A-T base pair: a DFT study.

Srinivasadesikan V, Sahu PK, Lee SL. Srinivasadesikan V, et al. Among authors: sahu pk. Spectrochim Acta A Mol Biomol Spectrosc. 2014;120:542-7. doi: 10.1016/j.saa.2013.11.110. Epub 2013 Dec 8. Spectrochim Acta A Mol Biomol Spectrosc. 2014. PMID: 24374481

10

Hydrogen-bond interaction in 1:1 complexes of tetrahydrofuran with water, hydrogen fluoride, and ammonia: a theoretical study.

Sahu PK, Lee SL. Sahu PK, et al. J Chem Phys. 2005 Jul 22;123(4):044308. doi: 10.1063/1.1938189. J Chem Phys. 2005. PMID: 16095359

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