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LigTMap: ligand and structure-based target identification and activity prediction for small molecular compounds Journal article
Shaikh, Faraz, Tai, Hio Kuan, Desai, Nirali, Siu, Shirley W.I.. LigTMap: ligand and structure-based target identification and activity prediction for small molecular compounds[J]. Journal of Cheminformatics, 2021, 13(1), 44.
Authors:  Shaikh, Faraz;  Tai, Hio Kuan;  Desai, Nirali;  Siu, Shirley W.I.
Favorite | TC[WOS]:15 TC[Scopus]:16  IF:7.1/9.3 | Submit date：2021/12/09
Binding Affinity Prediction  Binding Interaction Fingerprint  Drug Repurposing  Fingerprint Similarity  Inverse Docking  Psovina  Random Forest  Target Prediction  
Evaluating Variants of Firefly Algorithm for Ligand Pose Prediction in Protein-ligand Docking Program Conference paper
Ao, Meng Chi, Siu, Shirley W.I.. Evaluating Variants of Firefly Algorithm for Ligand Pose Prediction in Protein-ligand Docking Program[C], 2020, 48-54.
Authors:  Ao, Meng Chi;  Siu, Shirley W.I.
Favorite | TC[WOS]:0 TC[Scopus]:0 | Submit date：2021/12/06
Protein-ligand Docking  Firefly Algorithm  Particle Swarm Optimization  Psovina  Fireflyvina  Logistic Map  Lévy Flight  
Chaos-embedded particle swarm optimization approach for protein-ligand docking and virtual screening Journal article
Tai, Hio Kuan, Jusoh, Siti Azma, Siu, Shirley W. I.. Chaos-embedded particle swarm optimization approach for protein-ligand docking and virtual screening[J]. JOURNAL OF CHEMINFORMATICS, 2018, 10.
Authors:  Tai, Hio Kuan;  Jusoh, Siti Azma;  Siu, Shirley W. I.
Favorite | TC[WOS]:20 TC[Scopus]:22  IF:7.1/9.3 | 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
Lin H., Siu S.W.I.. A hybrid cuckoo search and differential evolution approach to protein–ligand docking[J]. International Journal of Molecular Sciences, 2018, 19(10).
Authors:  Lin H.;  Siu S.W.I.
Favorite | TC[WOS]:11 TC[Scopus]:13 | Submit date：2019/04/04
Autodock Vina  Conformational Search  Cuckoo Search  Cuckoovina  Differential Evolution  Metaheuristic  Optimization  Psovina  Structure-based Drug Design  
Improving the efficiency of PSOVina for protein-ligand docking by two-stage local search Conference paper
Tai H.K., Lin H., Siu S.W.I.. Improving the efficiency of PSOVina for protein-ligand docking by two-stage local search[C], 2016, 770-777.
Authors:  Tai H.K.;  Lin H.;  Siu S.W.I.
Favorite | TC[WOS]:7 TC[Scopus]:7 | Submit date：2019/04/04
Bfgs  Local Search  Optimization  Protein-ligand Docking  Pso  Psovina