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Khac‐Minh Thai

vietnam national university ho chi minh city (vnuhcm) system

22H-index
80Paper Count
1.3KCitation Count
Published Papers 27
Publication Date
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Validated virtual screening models for identifying allosteric inhibitors of ATP-citrate lyase: the role of docking scores and protein-ligand interaction similarity in hit selection
errMolecular Diversity
IF3.8
err2026-03-01
err0
PREAI
errMai, Tan Thanh; Lai, Nghia Vo-Trong; Lam, Thua-Phong; Truong, Lam Nguyen-Ngoc; Nguyen, My Ngoc; Nguyen, Nghi Van-Tuong; Phan, Minh-Hoang; Tuong, Lam-Truong; Thai, Khac-Minh
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Lotusin A: a novel pyrrole terpenoid hydrid from lotus roots (Nelumbo nucifera Gaertn.)
errRSC Adv.
IF0
err2025-12-16
err0
errOAAI
errLe Viet Ha Tran; Huu Canh Vo; To Hoang Long; Vinh Han La; Quoc Tuan Le; Minh Canh Nguyen; Duc Trung Le; Tran Dang Linh Nguyen; Thanh-Tung Phan; Ngo Thi Thuy Duong; Quang Ton That; Linh Tran; Minh-Tri Le; Khac-Minh Thai; Le-Thuy-Thuy-Trang Hoang; Huynh Nguyen Khanh Tran
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Antibody escape of SARS-CoV-2 variants of concern on receptor-binding domain: A computational approach
errJOURNAL OF THEORETICAL BIOLOGY
IF2
err2025-12-01
err0
PREAI
errNguyen, Dac-Nhan; Nguyen, Quoc-Thai; Dang, Thoai-My; Tran-Thi, Phuong-Uyen; Tran, Viet-Hung; Le, Minh-Tri; Tuong, Lam-Truong; Tran, Van-Thanh; Huynh, Phuong Nguyen Hoai; Thai, Khac-Minh
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Improved ADME Prediction by Multitask Pretraining on Predicted Data: Insights from the ASAP-Polaris-OpenADMET Blind Challenge
errJOURNAL OF CHEMICAL INFORMATION AND MODELING
IF5.3
err2025-12-01
err0
PREAI
errPham, Long-Hung Dinh; Le, Minh-Tri; Thai, Khac-Minh
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Achievements and Approaches in the Search for Small-Molecule Dengue NS2B/NS3 Inhibitors
errCURRENT MEDICINAL CHEMISTRY
IF3.5
err2025-01-27
err0
PREAI
errThai, Khac-Minh; Duong, Cuong Quoc; Mai, Tan Thanh; Le, Minh-Tri; Tran, Van-Thanh; Nguyen, Phuoc-Vinh; Tuong, Lam-Truong
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Binding ability of Delta and Omicron towards the angiotensin-converting enzyme 2 receptor and antibodies: a computational study
errJOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS
IF2.4
err2025-01-05
err0
PREAI
errQuoc-Thai Nguyen; Tan Thanh Mai; Lam-Truong Tuong; Thi-Thao-Nhung Nguyen; Thanh-Phuong Vo; Dac-Nhan Nguyen; Cong-Thanh Phan-Van; Dieu-Thuong Thi Trinh; Van-Thanh Tran; Khac-Minh Thai
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Identification of efflux pump inhibitors for Pseudomonas aeruginosa MexAB-OprM via ligand-based pharmacophores, 2D-QSAR, molecular docking, and molecular dynamics approaches
errMOLECULAR DIVERSITY
IF3.8
err2023-11-03
err3
PREAI
errPhan, Thien-Vy; Nguyen, Vu-Thuy-Vy; Le, Minh-Tri; Nguyen, Bao Gia Dang; Vu, Thanh-Thao; Thai, Khac-Minh
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Exploration of Remarkably Potential Multitarget-Directed N-Alkylated-2-(substituted phenyl)-1H-benzimidazole Derivatives as Antiproliferative, Antifungal, and Antibacterial Agents
errACS OMEGA
IF4.3
err2023-07-28
err15
errOAAI
errPhan, Ngoc-Kim-Ngan; Huynh, Thi-Kim-Chi; Nguyen, Hoang-Phuc; Le, Quoc-Tuan; Nguyen, Thi-Cam-Thu; Ngo, Kim-Khanh-Huy; Nguyen, Thi-Hong-An; Ton, Khoa Anh; Thai, Khac-Minh; Hoang, Thi-Kim-Dung
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Discovery of novel flavonoid derivatives as potential dual inhibitors against α-glucosidase and α-amylase: virtual screening, synthesis, and biological evaluation
errMOLECULAR DIVERSITY
IF3.8
err2023-06-27
err7
PREAI
errMai, Tan Thanh; Phan, Minh-Hoang; Thai, Thao Thi; Lam, Thua-Phong; Lai, Nghia Vo-Trong; Nguyen, Thanh-Thao; Nguyen, Thuy-Viet-Phuong; Vo, Cam-Van Thi; Thai, Khac-Minh; Tran, Thanh-Dao
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Heart rate variability during auricular acupressure at the left sympathetic point on healthy volunteers: a pilot study
errFRONTIERS IN NEUROSCIENCE
IF3.2
err2023-06-02
err4
errOAAI
errTrinh, Dieu-Thuong Thi; Le, Hoang-Linh Thi; Bui, Minh-Man Pham; Thai, Khac-Minh
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Identification of small molecules as potential inhibitors of interleukin 6: a multi-computational investigation
errMOLECULAR DIVERSITY
IF3.8
err2022-11-01
err5
errOAAI
errQue-Huong Tran; Quoc-Thai Nguyen; Thi-Thuy Nga Tran; Thanh-Dao Tran; Minh-Tri Le; Dieu-Thuong Thi Trinh; Van-Thanh Tran; Viet-Hung Tran; Khac-Minh Thai
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Discovery of small molecular inhibitors for interleukin-33/ST2 protein-protein interaction: a virtual screening, molecular dynamics simulations and binding free energy calculations
errMOLECULAR DIVERSITY
IF3.8
err2022-01-15
err14
errOAAI
errTan Thanh Mai; Phuc Gia Nguyen; Minh-Tri Le; Thanh-Dao Tran; Phuong Nguyen Hoai Huynh; Dieu-Thuong Thi Trinh; Quoc-Thai Nguyen; Khac-Minh Thai
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errSave
Structure-Based Discovery of ABCG2 Inhibitors: A Homology Protein-Based Pharmacophore Modeling and Molecular Docking Approach
errMOLECULES
IF4.6
err2021-05-23
err17
errOAAI
errLe, Minh-Tri; Hoang, Viet-Nham; Nguyen, Dac-Nhan; Bui, Thi-Hoang-Linh; Phan, Thien-Vy; Huynh, Phuong Nguyen-Hoai; Tran, Thanh-Dao; Thai, Khac-Minh
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Synthesis, In Silico and In Vitro Evaluation of Some Flavone Derivatives for Acetylcholinesterase and BACE-1 Inhibitory Activity
errMOLECULES
IF4.6
err2020-09-05
err21
errOAAI
errTran, Thai-Son; Tran, Thanh-Dao; Tran, The-Huan; Mai, Thanh-Tan; Nguyen, Ngoc-Le; Thai, Khac-Minh; Le, Minh-Tri
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Synthesis, In Silico and In Vitro Evaluation for Acetylcholinesterase and BACE-1 Inhibitory Activity of SomeN-Substituted-4-Phenothiazine-Chalcones
errMOLECULES
IF4.6
err2020-08-27
err12
errOAAI
errThai-Son Tran; Minh-Tri Le; Thi-Cam-Vi Nguyen; The-Huan Tran; Thanh-Dao Tran; Khac-Minh Thai
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Design of Curcumin and Flavonoid Derivatives with Acetylcholinesterase and Beta-Secretase Inhibitory Activities Using in Silico Approaches
errMOLECULES
IF4.6
err2020-08-10
err18
errOAAI
errTran, Thai-Son; Le, Minh-Tri; Tran, Thanh-Dao; Tran, The-Huan; Thai, Khac-Minh
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Prediction model of human ABCC2/MRP2 efflux pump inhibitors: a QSAR study
errMOLECULAR DIVERSITY
IF3.8
err2020-02-11
err6
PREAI
errMinh-Tri Le; Thien-Vy Phan; Viet-Khoa Tran-Nguyen; Thanh-Dao Tran; Khac-Minh Thai
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Computational predictive models for P-glycoprotein inhibition of in-house chalcone derivatives and drug-bank compounds
errMOLECULAR DIVERSITY
IF3.8
err2016-07-18
err44
PREAI
errTrieu-Du Ngo; Thanh-Dao Tran; Minh-Tri Le; Khac-Minh Thai
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Synthesis and Selective Cytotoxic Activities on Rhabdomyosarcoma and Noncancerous Cells of Some Heterocyclic Chalcones
errMOLECULES
IF4.6
err2016-03-09
err12
errOAAI
errTuong-Ha Do; Dai-Minh Nguyen; Van-Dat Truong; Thi-Hong-Tuoi Do; Minh-Tri Le; Thanh-Quan Pham; Khac-Minh Thai; Thanh-Dao Tran
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errSave
Synthesis and Antibacterial Activity of Some Heterocyclic Chalcone Analogues Alone and in Combination with Antibiotics
errMOLECULES
IF4.6
err2012-06-01
err101
errOAAI
errThanh-Dao Tran; Thi-Thao-Nhu Nguyen; Tuong-Ha Do; Thi-Ngoc-Phuong Huynh; Cat-Dong Tran; Khac-Minh Thai
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Research Directions

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Co-authors
Cooperation Journals
G
Gerhard F. Ecker
H-index: 69 · Papers: 568
S
Steffen Hering
H-index: 46 · Papers: 254
M
Minh-Tri Le
H-index: 22 · Papers: 161
A
Anna Stary‐Weinzinger
H-index: 21 · Papers: 111
E
Eugen Timin
H-index: 20 · Papers: 103
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