Sahai MA - Search Results

1

Transition state infrared spectra for the trans-->cis isomerization of a simple peptide model.

Sahai MA, Szöri M, Viskolcz B, Pai EF, Csizmadia IG. Sahai MA, et al. J Phys Chem A. 2007 Aug 30;111(34):8384-9. doi: 10.1021/jp074991f. Epub 2007 Aug 9. J Phys Chem A. 2007. PMID: 17685601

2

First principle computational study on the full conformational space of L-proline diamides.

Sahai MA, Kehoe TA, Koo JC, Setiadi DH, Chass GA, Viskolcz B, Penke B, Pai EF, Csizmadia IG. Sahai MA, et al. J Phys Chem A. 2005 Mar 24;109(11):2660-79. doi: 10.1021/jp040594i. J Phys Chem A. 2005. PMID: 16833573

3

First-principle computational study on the full conformational space of L-threonine diamide, the energetic stability of cis and trans isomers.

Sahai MA, Fejer SN, Viskolcz B, Pai EF, Csizmadia IG. Sahai MA, et al. J Phys Chem A. 2006 Oct 12;110(40):11527-36. doi: 10.1021/jp0680488. J Phys Chem A. 2006. PMID: 17020266

4

Quantifying the intrinsic effects of two point mutation models of proline-proline diamino acid diamide: a first-principle computational study.

Sahai MA, Viskolcz B, Pai EF, Csizmadia IG. Sahai MA, et al. J Phys Chem B. 2007 Oct 4;111(39):11592-602. doi: 10.1021/jp073471h. Epub 2007 Sep 8. J Phys Chem B. 2007. PMID: 17824687

5

Quantifying the intrinsic effects of two point mutation models of pro-pro-pro triamino acid diamide. A first-principle computational study.

Sahai MA, Viskolcz B, Pai EF, Csizmadia IG. Sahai MA, et al. J Phys Chem B. 2007 Nov 15;111(45):13135-42. doi: 10.1021/jp074046r. Epub 2007 Oct 20. J Phys Chem B. 2007. PMID: 17949073

6

Quantifying water-mediated protein-ligand interactions in a glutamate receptor: a DFT study.

Sahai MA, Biggin PC. Sahai MA, et al. J Phys Chem B. 2011 Jun 2;115(21):7085-96. doi: 10.1021/jp200776t. Epub 2011 May 5. J Phys Chem B. 2011. PMID: 21545106 Free PMC article.

7

A comparative analysis of the role of water in the binding pockets of ionotropic glutamate receptors.

Vijayan R, Sahai MA, Czajkowski T, Biggin PC. Vijayan R, et al. Among authors: sahai ma. Phys Chem Chem Phys. 2010 Nov 14;12(42):14057-66. doi: 10.1039/c004336b. Epub 2010 Sep 20. Phys Chem Chem Phys. 2010. PMID: 20856958

8

Case study: Biochemistry without borders: a case study utilising infographics.

Sahai MA, Ivanova A. Sahai MA, et al. Essays Biochem. 2022 Apr 29;66(1):65-73. doi: 10.1042/EBC20210040. Essays Biochem. 2022. PMID: 35411387

9

Molecular mechanisms of action of stimulant novel psychoactive substances that target the high-affinity transporter for dopamine.

Sahai MA, Opacka-Juffry J. Sahai MA, et al. Neuronal Signal. 2021 Nov 17;5(4):NS20210006. doi: 10.1042/NS20210006. eCollection 2021 Dec. Neuronal Signal. 2021. PMID: 34888062 Free PMC article. Review.

10

The Role of Dopamine in the Stimulant Characteristics of Novel Psychoactive Substances (NPS)-Neurobiological and Computational Assessment Using the Case of Desoxypipradrol (2-DPMP).

Loi B, Sahai MA, De Luca MA, Shiref H, Opacka-Juffry J. Loi B, et al. Among authors: sahai ma. Front Pharmacol. 2020 Jun 5;11:806. doi: 10.3389/fphar.2020.00806. eCollection 2020. Front Pharmacol. 2020. PMID: 32670057 Free PMC article.

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