Cherkasov A - Search Results

1

An updated steroid benchmark set and its application in the discovery of novel nanomolar ligands of sex hormone-binding globulin.

Cherkasov A, Ban F, Santos-Filho O, Thorsteinson N, Fallahi M, Hammond GL. Cherkasov A, et al. J Med Chem. 2008 Apr 10;51(7):2047-56. doi: 10.1021/jm7011485. Epub 2008 Mar 11. J Med Chem. 2008. PMID: 18330978

2

Successful in silico discovery of novel nonsteroidal ligands for human sex hormone binding globulin.

Cherkasov A, Shi Z, Fallahi M, Hammond GL. Cherkasov A, et al. J Med Chem. 2005 May 5;48(9):3203-13. doi: 10.1021/jm049087f. J Med Chem. 2005. PMID: 15857126

3

'Inductive' charges on atoms in proteins: comparative docking with the extended steroid benchmark set and discovery of a novel SHBG ligand.

Cherkasov A, Shi Z, Li Y, Jones SJ, Fallahi M, Hammond GL. Cherkasov A, et al. J Chem Inf Model. 2005 Nov-Dec;45(6):1842-53. doi: 10.1021/ci0498158. J Chem Inf Model. 2005. PMID: 16309292

4

Can 'Bacterial-Metabolite-Likeness' model improve odds of 'in silico' antibiotic discovery?

Cherkasov A. Cherkasov A. J Chem Inf Model. 2006 May-Jun;46(3):1214-22. doi: 10.1021/ci050480j. J Chem Inf Model. 2006. PMID: 16711741

5

Progressive docking: a hybrid QSAR/docking approach for accelerating in silico high throughput screening.

Cherkasov A, Ban F, Li Y, Fallahi M, Hammond GL. Cherkasov A, et al. J Med Chem. 2006 Dec 14;49(25):7466-78. doi: 10.1021/jm060961+. J Med Chem. 2006. PMID: 17149875

6

Indel-based targeting of essential proteins in human pathogens that have close host orthologue(s): discovery of selective inhibitors for Leishmania donovani elongation factor-1alpha.

Nandan D, Lopez M, Ban F, Huang M, Li Y, Reiner NE, Cherkasov A. Nandan D, et al. Among authors: cherkasov a. Proteins. 2007 Apr 1;67(1):53-64. doi: 10.1002/prot.21278. Proteins. 2007. PMID: 17243179

7

Application of 'inductive' QSAR descriptors for quantification of antibacterial activity of cationic polypeptides.

Cherkasov A, Jankovic B. Cherkasov A, et al. Molecules. 2004 Dec 31;9(12):1034-52. doi: 10.3390/91201034. Molecules. 2004. PMID: 18007503 Free PMC article.

8

In silico identification of anthropogenic chemicals as ligands of zebrafish sex hormone binding globulin.

Thorsteinson N, Ban F, Santos-Filho O, Tabaei SM, Miguel-Queralt S, Underhill C, Cherkasov A, Hammond GL. Thorsteinson N, et al. Among authors: cherkasov a. Toxicol Appl Pharmacol. 2009 Jan 1;234(1):47-57. doi: 10.1016/j.taap.2008.07.014. Epub 2008 Jul 25. Toxicol Appl Pharmacol. 2009. PMID: 18725242

9

Using molecular docking, 3D-QSAR, and cluster analysis for screening structurally diverse data sets of pharmacological interest.

Santos-Filho OA, Cherkasov A. Santos-Filho OA, et al. Among authors: cherkasov a. J Chem Inf Model. 2008 Oct;48(10):2054-65. doi: 10.1021/ci8001952. Epub 2008 Sep 24. J Chem Inf Model. 2008. PMID: 18816024

10

Identification of novel antibacterial peptides by chemoinformatics and machine learning.

Fjell CD, Jenssen H, Hilpert K, Cheung WA, Panté N, Hancock RE, Cherkasov A. Fjell CD, et al. Among authors: cherkasov a. J Med Chem. 2009 Apr 9;52(7):2006-15. doi: 10.1021/jm8015365. J Med Chem. 2009. PMID: 19296598

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