Salmas RE - Search Results

1

Fullerene-based inhibitors of HIV-1 protease.

Strom TA, Durdagi S, Ersoz SS, Salmas RE, Supuran CT, Barron AR. Strom TA, et al. Among authors: salmas re. J Pept Sci. 2015 Dec;21(12):862-70. doi: 10.1002/psc.2828. J Pept Sci. 2015. PMID: 26767741

2

Kinetic and docking studies of cytosolic/tumor-associated carbonic anhydrase isozymes I, II and IX with some hydroxylic compounds.

Durdagi S, Korkmaz N, Işık S, Vullo D, Astley D, Ekinci D, Salmas RE, Senturk M, Supuran CT. Durdagi S, et al. Among authors: salmas re. J Enzyme Inhib Med Chem. 2016 Dec;31(6):1214-20. doi: 10.3109/14756366.2015.1114930. Epub 2015 Dec 4. J Enzyme Inhib Med Chem. 2016. PMID: 26634620

3

In silico investigation of PARP-1 catalytic domains in holo and apo states for the design of high-affinity PARP-1 inhibitors.

Salmas RE, Unlu A, Yurtsever M, Noskov SY, Durdagi S. Salmas RE, et al. J Enzyme Inhib Med Chem. 2016;31(1):112-20. doi: 10.3109/14756366.2015.1005011. Epub 2015 Jun 17. J Enzyme Inhib Med Chem. 2016. PMID: 26083304

4

Investigation of Inhibition Mechanism of Chemokine Receptor CCR5 by Micro-second Molecular Dynamics Simulations.

Salmas RE, Yurtsever M, Durdagi S. Salmas RE, et al. Sci Rep. 2015 Aug 24;5:13180. doi: 10.1038/srep13180. Sci Rep. 2015. PMID: 26299310 Free PMC article.

5

Carbonic anhydrase inhibitors: Design, synthesis, kinetic, docking and molecular dynamics analysis of novel glycine and phenylalanine sulfonamide derivatives.

Fidan İ, Salmas RE, Arslan M, Şentürk M, Durdagi S, Ekinci D, Şentürk E, Coşgun S, Supuran CT. Fidan İ, et al. Among authors: salmas re. Bioorg Med Chem. 2015 Dec 1;23(23):7353-8. doi: 10.1016/j.bmc.2015.10.009. Epub 2015 Oct 23. Bioorg Med Chem. 2015. PMID: 26534780

6

Mutated form (G52E) of inactive diphtheria toxin CRM197: molecular simulations clearly display effect of the mutation to NAD binding.

Salmas RE, Mestanoglu M, Unlu A, Yurtsever M, Durdagi S. Salmas RE, et al. J Biomol Struct Dyn. 2016 Nov;34(11):2462-8. doi: 10.1080/07391102.2015.1119060. Epub 2016 Feb 2. J Biomol Struct Dyn. 2016. PMID: 26836774

7

Acetylcholinesterase and carbonic anhydrase inhibitory properties of novel urea and sulfamide derivatives incorporating dopaminergic 2-aminotetralin scaffolds.

Özgeriş B, Göksu S, Polat Köse L, Gülçin İ, Salmas RE, Durdagi S, Tümer F, Supuran CT. Özgeriş B, et al. Among authors: salmas re. Bioorg Med Chem. 2016 May 15;24(10):2318-29. doi: 10.1016/j.bmc.2016.04.002. Epub 2016 Apr 2. Bioorg Med Chem. 2016. PMID: 27068142

8

The synthesis of novel sulfamides derived from β-benzylphenethylamines as acetylcholinesterase, butyrylcholinesterase and carbonic anhydrase enzymes inhibitors.

Akıncıoğlu A, Kocaman E, Akıncıoğlu H, Salmas RE, Durdagi S, Gülçin İ, Supuran CT, Göksu S. Akıncıoğlu A, et al. Among authors: salmas re. Bioorg Chem. 2017 Oct;74:238-250. doi: 10.1016/j.bioorg.2017.08.012. Epub 2017 Aug 23. Bioorg Chem. 2017. PMID: 28866249

9

Discovery of selective dengue virus inhibitors using combination of molecular fingerprint-based virtual screening protocols, structure-based pharmacophore model development, molecular dynamics simulations and in vitro studies.

Mirza SB, Lee RCH, Chu JJH, Salmas RE, Mavromoustakos T, Durdagi S. Mirza SB, et al. Among authors: salmas re. J Mol Graph Model. 2018 Jan;79:88-102. doi: 10.1016/j.jmgm.2017.10.010. Epub 2017 Oct 24. J Mol Graph Model. 2018. PMID: 29156382

10

Atomistic molecular dynamics simulations of typical and atypical antipsychotic drugs at the dopamine D2 receptor (D2R) elucidates their inhibition mechanism.

Salmas RE, Yurtsever M, Durdagi S. Salmas RE, et al. J Biomol Struct Dyn. 2017 Mar;35(4):738-754. doi: 10.1080/07391102.2016.1159986. Epub 2016 Apr 6. J Biomol Struct Dyn. 2017. PMID: 26923489

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