Hocheol Lim

Institute of Molecular Sciences and Bioinformatics — Pakistan

Computer Science · Physical Sciences

11h-index398citations31works3.32yr avg
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Research Topics

Computational Drug Discovery Methods(5), Monoclonal and Polyclonal Antibodies Research(5), Quantum Information and Cryptography(3), Cancer, Hypoxia, and Metabolism(3), Quantum Computing Algorithms and Architecture(3)

Publications31 total

Nutrient Availability Dictates Cancer Metabolism-Based Therapeutic Responses to Non-oncology Drugs
Cancer Research·2025Open Access
Discovery of PAR2 antagonists through fragment molecular orbital-based hotspot analysis and allosteric sodium site dynamics simulations
Bioorganic Chemistry·2025
SAGE-prot: scoring-assisted generative exploration for multi-objective protein design
Briefings in Bioinformatics·2025Open Access
Correction to “Development and Evaluation of Indole-Based Phospholipase D Inhibitors for Lung Cancer Immunotherapy”
Journal of Medicinal Chemistry·2025
Nutrient availability dictates cancer metabolism-based therapeutic responses of non-oncology drugs
2025Open Access
Development of Drug-Induced Gene Expression Ranking Analysis (DIGERA) and Its Application to Virtual Screening for Poly (ADP-Ribose) Polymerase 1 Inhibitor
International Journal of Molecular Sciences·2024Open Access
Development and Evaluation of Indole-Based Phospholipase D Inhibitors for Lung Cancer Immunotherapy
Journal of Medicinal Chemistry·2024· 5 citedOpen Access
Correction: Inhibition of IRP2-dependent reprogramming of iron metabolism suppresses tumor growth in colorectal cancer
Cell Communication and Signaling·2024Open Access
Extension of scoring-assisted generative exploration for ionic liquids (SAGE-IL) and its application to ionic liquid design for CO2 capture
Materials Today Advances·2024· 3 citedOpen Access
Inhibition of IRP2-dependent reprogramming of iron metabolism suppresses tumor growth in colorectal cancer
Cell Communication and Signaling·2024· 14 citedOpen Access
Discovery of Protease-activated receptor 2 antagonists derived from phenylalanine for the treatment of breast cancer
Bioorganic Chemistry·2024· 2 cited
Development of scoring-assisted generative exploration (SAGE) and its application to dual inhibitor design for acetylcholinesterase and monoamine oxidase B
Journal of Cheminformatics·2024· 5 citedOpen Access
Abstract 5937: KS20226, a first-in-class IRP2 inhibitor, preferentially induces reprogramming of iron metabolism and suppresses tumor growth in colorectal cancer
Cancer Research·2024
Fragment molecular orbital-based variational quantum eigensolver for quantum chemistry in the age of quantum computing
Scientific Reports·2024· 21 citedOpen Access
Discovery of Protease-Activated Receptor 2 Antagonists Derived from Phenylalanine for the Treatment of Breast Cancer
SSRN Electronic Journal·2024Open Access
Fragment Molecular Orbital-based Variational Quantum Eigensolver for Quantum Chemistry in the Age of Quantum Computing
Research Square (Research Square)·2023Open Access
Intracellular Loop in the Brain Isoforms of Anoctamin 2 Channels Regulates Calcium-dependent Activation
Experimental Neurobiology·2023· 1 citedOpen Access
Prediction of polyreactive and nonspecific single-chain fragment variables through structural biochemical features and protein language-based descriptors
BMC Bioinformatics·2022· 12 citedOpen Access
Quantum computational study of chloride attack on chloromethane for chemical accuracy and quantum noise effects with UCCSD and k-UpCCGSD ansatzes
Scientific Reports·2022· 5 citedOpen Access
Identification of Novel Natural Product Inhibitors against Matrix Metalloproteinase 9 Using Quantum Mechanical Fragment Molecular Orbital-Based Virtual Screening Methods
International Journal of Molecular Sciences·2022· 16 citedOpen Access
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Frequent Co-authors

Kyoung Tai No(23), Jongwan Kim(8), Ayoung Baek(5), Hyeon-Nae Jeon(5), Gyoonhee Han(5), W. Namkung(5), June‐Koo Kevin Rhee(4), Do Sik Min(3), Xuemei Jin(3), Hyein Cho(3), Byungdu Oh(3), Jieon Hwang(3), Areum Park(3), Chinwoo Kim(3), Chang Gon Kim(3), Jaesung Kwak(3), Byungil Kim(3), Hyun‐Jin Shin(3), Minhee Ku(3), Jaemoon Yang(3)