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Elucidating specific interactions for designing novel pyrrolamide derivatives as potential GyrB inhibitors based on ab initio fragment molecular orbital calculations.
J Biomol Struct Dyn. 2023 Dec 8:1-14. doi: 10.1080/07391102.2023.2291178. Online ahead of print.
J Biomol Struct Dyn. 2023.
PMID: 38063158
Toward the early diagnosis of tuberculosis: A gold particle-decorated graphene-modified paper-based electrochemical biosensor for Hsp16.3 detection.
Pornprom T, Phusi N, Thongdee P, Pakamwong B, Sangswan J, Kamsri P, Punkvang A, Suttisintong K, Leanpolchareanchai J, Hongmanee P, Lumjiaktase P, Jampasa S, Chailapakul O, Pungpo P.
Pornprom T, et al. Among authors: phusi n.
Talanta. 2024 Jan 15;267:125210. doi: 10.1016/j.talanta.2023.125210. Epub 2023 Sep 14.
Talanta. 2024.
PMID: 37717539
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Bioisosteric Design Identifies Inhibitors of Mycobacterium tuberculosis DNA Gyrase ATPase Activity.
Kamsri B, Pakamwong B, Thongdee P, Phusi N, Kamsri P, Punkvang A, Ketrat S, Saparpakorn P, Hannongbua S, Sangswan J, Suttisintong K, Sureram S, Kittakoop P, Hongmanee P, Santanirand P, Leanpolchareanchai J, Goudar KE, Spencer J, Mulholland AJ, Pungpo P.
Kamsri B, et al. Among authors: phusi n.
J Chem Inf Model. 2023 May 8;63(9):2707-2718. doi: 10.1021/acs.jcim.2c01376. Epub 2023 Apr 19.
J Chem Inf Model. 2023.
PMID: 37074047
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Structure-based drug design of novel M. tuberculosis InhA inhibitors based on fragment molecular orbital calculations.
Phusi N, Hashimoto Y, Otsubo N, Imai K, Thongdee P, Sukchit D, Kamsri P, Punkvang A, Suttisintong K, Pungpo P, Kurita N.
Phusi N, et al.
Comput Biol Med. 2023 Jan;152:106434. doi: 10.1016/j.compbiomed.2022.106434. Epub 2022 Dec 19.
Comput Biol Med. 2023.
PMID: 36543008
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Discovery of novel and potent InhA inhibitors by an in silico screening and pharmacokinetic prediction.
Hanwarinroj C, Phusi N, Kamsri B, Kamsri P, Punkvang A, Ketrat S, Saparpakorn P, Hannongbua S, Suttisintong K, Kittakoop P, Spencer J, Mulholland AJ, Pungpo P.
Hanwarinroj C, et al. Among authors: phusi n.
Future Med Chem. 2022 May;14(10):717-729. doi: 10.4155/fmc-2021-0348. Epub 2022 Apr 29.
Future Med Chem. 2022.
PMID: 35485258
Free article.
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Identification of Potent DNA Gyrase Inhibitors Active against Mycobacterium tuberculosis.
Pakamwong B, Thongdee P, Kamsri B, Phusi N, Kamsri P, Punkvang A, Ketrat S, Saparpakorn P, Hannongbua S, Ariyachaokun K, Suttisintong K, Sureram S, Kittakoop P, Hongmanee P, Santanirand P, Spencer J, Mulholland AJ, Pungpo P.
Pakamwong B, et al. Among authors: phusi n.
J Chem Inf Model. 2022 Apr 11;62(7):1680-1690. doi: 10.1021/acs.jcim.1c01390. Epub 2022 Mar 29.
J Chem Inf Model. 2022.
PMID: 35347987
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Discovery of New and Potent InhA Inhibitors as Antituberculosis Agents: Structure-Based Virtual Screening Validated by Biological Assays and X-ray Crystallography.
Kamsri P, Hanwarinroj C, Phusi N, Pornprom T, Chayajarus K, Punkvang A, Suttipanta N, Srimanote P, Suttisintong K, Songsiriritthigul C, Saparpakorn P, Hannongbua S, Rattanabunyong S, Seetaha S, Choowongkomon K, Sureram S, Kittakoop P, Hongmanee P, Santanirand P, Chen Z, Zhu W, Blood RA, Takebayashi Y, Hinchliffe P, Mulholland AJ, Spencer J, Pungpo P.
Kamsri P, et al. Among authors: phusi n.
J Chem Inf Model. 2020 Jan 27;60(1):226-234. doi: 10.1021/acs.jcim.9b00918. Epub 2019 Dec 27.
J Chem Inf Model. 2020.
PMID: 31820972
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Specific interactions between 2-trans enoyl-acyl carrier protein reductase and its ligand: Protein-ligand docking and ab initio fragment molecular orbital calculations.
Phusi N, Sato R, Ezawa T, Tomioka S, Hanwarinroj C, Khamsri B, Kamsri P, Punkvang A, Pungpo P, Kurita N.
Phusi N, et al.
J Mol Graph Model. 2019 May;88:299-308. doi: 10.1016/j.jmgm.2019.02.011. Epub 2019 Feb 25.
J Mol Graph Model. 2019.
PMID: 30826710
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