Rasulev BF - Search Results

1

Aconitum and Delphinium alkaloids of curare-like activity. QSAR analysis and molecular docking of alkaloids into AChBP.

Turabekova MA, Rasulev BF, Dzhakhangirov FN, Leszczynska D, Leszczynski J. Turabekova MA, et al. Among authors: rasulev bf. Eur J Med Chem. 2010 Sep;45(9):3885-94. doi: 10.1016/j.ejmech.2010.05.042. Epub 2010 May 26. Eur J Med Chem. 2010. PMID: 20594622

2

Combined Machine Learning, Computational, and Experimental Analysis of the Iridium(III) Complexes with Red to Near-Infrared Emission.

Karuth A, Casanola-Martin GM, Lystrom L, Sun W, Kilin D, Kilina S, Rasulev B. Karuth A, et al. J Phys Chem Lett. 2024 Jan 18;15(2):471-480. doi: 10.1021/acs.jpclett.3c02533. Epub 2024 Jan 8. J Phys Chem Lett. 2024. PMID: 38190332

3

Quantitative Structure-Permittivity Relationship Study of a Series of Polymers.

Zhuravskyi Y, Iduoku K, Erickson ME, Karuth A, Usmanov D, Casanola-Martin G, Sayfiyev MN, Ziyaev DA, Smanova Z, Mikolajczyk A, Rasulev B. Zhuravskyi Y, et al. ACS Mater Au. 2024 Jan 9;4(2):195-203. doi: 10.1021/acsmaterialsau.3c00079. eCollection 2024 Mar 13. ACS Mater Au. 2024. PMID: 38496050 Free PMC article.

4

Stability Constant and Potentiometric Sensitivity of Heavy Metal-Organic Fluorescent Compound Complexes: QSPR Models for Prediction and Design of Novel Coumarin-like Ligands.

Diem-Tran PT, Ho TT, Tuan NV, Bao LQ, Phuong HT, Chau TTG, Minh HTB, Nguyen CT, Smanova Z, Casanola-Martin GM, Rasulev B, Pham-The H, Cuong LCV. Diem-Tran PT, et al. Toxics. 2023 Jul 7;11(7):595. doi: 10.3390/toxics11070595. Toxics. 2023. PMID: 37505560 Free PMC article.

5

The Hydrolysis Rate of Paraoxonase-1 Q and R Isoenzymes: An In Silico Study Based on In Vitro Data.

Karabulut S, Mansour B, Casanola-Martin GM, Rasulev B, Gauld JW. Karabulut S, et al. Molecules. 2022 Oct 11;27(20):6780. doi: 10.3390/molecules27206780. Molecules. 2022. PMID: 36296373 Free PMC article.

6

Phenolic Acid-β-Cyclodextrin Complexation Study to Mask Bitterness in Wheat Bran: A Machine Learning-Based QSAR Study.

Iduoku K, Ngongang M, Kulathunga J, Daghighi A, Casanola-Martin G, Simsek S, Rasulev B. Iduoku K, et al. Foods. 2024 Jul 6;13(13):2147. doi: 10.3390/foods13132147. Foods. 2024. PMID: 38998653 Free PMC article.

7

Structural Features Promoting Photocatalytic Degradation of Contaminants of Emerging Concern: Insights into Degradation Mechanism Employing QSA/PR Modeling.

Tomic A, Kovacic M, Kusic H, Karamanis P, Rasulev B, Loncaric Bozic A. Tomic A, et al. Molecules. 2023 Mar 7;28(6):2443. doi: 10.3390/molecules28062443. Molecules. 2023. PMID: 36985414 Free PMC article.

8

Development of Activity Rules and Chemical Fragment Design for In Silico Discovery of AChE and BACE1 Dual Inhibitors against Alzheimer's Disease.

Bao LQ, Baecker D, Mai Dung DT, Phuong Nhung N, Thi Thuan N, Nguyen PL, Phuong Dung PT, Huong TTL, Rasulev B, Casanola-Martin GM, Nam NH, Pham-The H. Bao LQ, et al. Molecules. 2023 Apr 20;28(8):3588. doi: 10.3390/molecules28083588. Molecules. 2023. PMID: 37110831 Free PMC article.

9

From RNA sequence to its three-dimensional structure: geometrical structure, stability and dynamics of selected fragments of SARS-CoV-2 RNA.

Gorb L, Voiteshenko I, Hurmach V, Zarudnaya M, Nyporko A, Shyryna T, Platonov M, Roszak S, Rasulev B. Gorb L, et al. NAR Genom Bioinform. 2024 Jun 4;6(2):lqae062. doi: 10.1093/nargab/lqae062. eCollection 2024 Jun. NAR Genom Bioinform. 2024. PMID: 38835951 Free PMC article.

10

Design and evaluation of nanoscale materials with programmed responsivity towards epigenetic enzymes.

Ray P, Sedigh A, Confeld M, Alhalhooly L, Iduoku K, Casanola-Martin GM, Pham-The H, Rasulev B, Choi Y, Yang Z, Mallik S, Quadir M. Ray P, et al. J Mater Chem B. 2024 Oct 9;12(39):9905-9920. doi: 10.1039/d4tb00514g. J Mater Chem B. 2024. PMID: 39021201

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