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LigTMap: ligand and structure-based target identification and activity prediction for small molecular compounds Journal article
Journal of Cheminformatics, 2021,Volume: 13,Issue: 1
Authors:  Shaikh, Faraz;  Tai, Hio Kuan;  Desai, Nirali;  Siu, Shirley W.I.
Favorite |  | TC[WOS]:2 TC[Scopus]:2 | Submit date:2021/12/09
Binding Affinity Prediction  Binding Interaction Fingerprint  Drug Repurposing  Fingerprint Similarity  Inverse Docking  Psovina  Random Forest  Target Prediction  
Curcumin prevents As3+-induced carcinogenesis through regulation of GSK3β/Nrf2 Journal article
Chinese Medicine, 2021,Volume: 16,Issue: 1
Authors:  Dang, Yuan Ye;  Luo, Hua;  Li, Yong Mei;  Zhou, Yang;  Luo, Xiu;  Lin, Shui Mu;  Liu, Shou Ping;  Lee, Simon Ming Yuen;  Li, Chu Wen;  Dai, Xiao Yan
Favorite |  | TC[WOS]:3 TC[Scopus]:2 | Submit date:2021/12/08
Arsenic  Autophagy  Carcinogenesis  Curcumin  Gsk-3β/β-trcp  Nrf2  Ros  
Anticancer effects of asiatic acid against doxorubicin-resistant breast cancer cells via an AMPK-dependent pathway in vitro Journal article
Phytomedicine, 2021,Volume: 92
Authors:  Zhu, Zhu;  Cui, Liao;  Yang, Jing;  Vong, Chi Teng;  Hu, Yuanjia;  Xiao, Jianbo;  Chan, Ging;  He, Zhiwei;  Zhong, Zhangfeng
Favorite |  | TC[WOS]:4 TC[Scopus]:6 | Submit date:2021/12/08
Asiatic Acid  Breast Cancer  Centella Asiatica  Chemoresistance  Doxorubicin  
GWOVina: A grey wolf optimization approach to rigid and flexible receptor docking Journal article
Chemical Biology and Drug Design, 2021,Volume: 97,Issue: 1,Page: 97-110
Authors:  Wong, Kin Meng;  Tai, Hio Kuan;  Siu, Shirley W.I.
Favorite |  | TC[WOS]:7 TC[Scopus]:8 | Submit date:2021/12/07
Autodock Vina  Gwovina  Nature-inspired Algorithm  Protein–ligand Docking  Side-chain Flexibility  Structure-based Drug Design  Swarm Intelligence  
Evaluating Variants of Firefly Algorithm for Ligand Pose Prediction in Protein-ligand Docking Program Conference paper
ICBBT 2020: Proceedings of the 2020 12th International Conference on Bioinformatics and Biomedical Technology, Xi'an, 22 May 2020 through 24 May 2020
Authors:  Ao, Meng Chi;  Siu, Shirley W.I.
Favorite |  | TC[WOS]:0 TC[Scopus]:0 | Submit date:2021/12/06
Chaos-embedded particle swarm optimization approach for protein-ligand docking and virtual screening Journal article
JOURNAL OF CHEMINFORMATICS, 2018,Volume: 10
Authors:  Tai, Hio Kuan;  Jusoh, Siti Azma;  Siu, Shirley W. I.
Favorite |  | TC[WOS]:13 TC[Scopus]:15 | Submit date:2019/01/17
Docking  Virtual Screening  Psovina  Autodock Vina  Chaotic Maps  Singer Map  Sinusoidal Map  
A hybrid cuckoo search and differential evolution approach to protein–ligand docking Journal article
International Journal of Molecular Sciences, 2018,Volume: 19,Issue: 10
Authors:  Lin H.;  Siu S.W.I.
Favorite |  | TC[WOS]:7 TC[Scopus]:10 | Submit date:2019/04/04
Autodock Vina  Conformational Search  Cuckoo Search  Cuckoovina  Differential Evolution  Metaheuristic  Optimization  Psovina  Structure-based Drug Design  
Modeling analysis of potential target of dolastatin 16 by computational virtual screening Journal article
Chemical and Pharmaceutical Bulletin, 2018,Volume: 66,Issue: 6,Page: 602-607
Authors:  Liang T.-T.;  Zhao Q.;  He S.;  Mu F.-Z.;  Deng W.;  Han B.-N.
Favorite |  | TC[WOS]:6 TC[Scopus]:7 | Submit date:2019/01/16
Dolastatin 16  Fkbp1a  Molecular Docking  Pharmmapper  
Modeling analysis of potential target of dolastatin 16 by computational virtual screening Journal article
Chemical and Pharmaceutical Bulletin, 2018,Volume: 66,Issue: 6,Page: 602-607
Authors:  Liang,Ting Ting;  Zhao,Qi;  He,Shan;  Mu,Fang Zhou;  Deng,Wei;  Han,Bing Nan
Favorite |  | TC[WOS]:6 TC[Scopus]:7 | Submit date:2021/03/04
Dolastatin 16  FKBP1A  Molecular docking  PharmMapper  
Substantial protection against MPTP-associated Parkinson's neurotoxicity in vitro and in vivo by anti-cancer agent SU4312 via activation of MEF2D and inhibition of MAO-B Journal article
NEUROPHARMACOLOGY, 2017,Volume: 126,Page: 12-24
Authors:  Guo, Baojian;  Hu, Shengquan;  Zheng, Chengyou;  Wang, Hongyu;  Luo, Fangcheng;  Li, Haitao;  Cui, Wei;  Yang, Xifei;  Cui, Guozhen;  Mak, Shinghung;  Choi, Tony Chung-Lit;  Ma, Edmond Dik-Lung;  Wang, Yuqiang;  Lee, Simon Ming Yuen;  Zhang, Zaijun;  Han, Yifan
View | Adobe PDF | Favorite |  | TC[WOS]:16 TC[Scopus]:18 | Submit date:2018/10/31
Parkinson's disease  SU4312  Neuroprotection  Myocyte enhancer factor 2D  Monoamine oxidase-B