Supa Hannongbua

kasetsart university

H指数:30

被引数:3,466

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Identification of potential SARS-CoV-2 Mpro inhibitors from a Thai natural product database via interaction fingerprint-based virtual screening

通过基于相互作用指纹的虚拟筛选，从泰国天然产物数据库中鉴定潜在的SARS-CoV-2 Mpro抑制剂

Journal of Computer-Aided Molecular Design

IF3.1

2026-09-180

PRE

Investigation of the Structural and Photophysical Properties of Cyclometalated Platinum(II) Complexes as Singlet Oxygen Photosensitizers for Photodynamic Therapy: A DFT Computational Study

探究环金属化铂(II)配合物作为光动力疗法单线态氧光敏剂的结构与光物理性质：一项DFT计算研究

Chiang Mai Journal of Science

IF0.8

2026-05-010

PRE

Binding investigation of non-toxic compounds from plant-based repellents targeting Aedes aegypti odorant-binding protein 1 using molecular dynamics simulations and density functional theory

利用分子动力学模拟和密度泛函理论，对靶向埃及伊蚊气味结合蛋白1的植物源性驱避剂中的无毒化合物进行结合研究

Microbial Pathogenesis

IF3.5

2025-12-200

PRE

Role of triterpenoid derivatives from Centella asiatica as quantum chemical calculations

从Centella asiatica中提取的三萜类衍生物在量子化学计算中的作用

Journal of Biomolecular Structure and Dynamics

IF2.4

2025-11-070

PRE

Bifunctional Molecular Bridges for Enhanced Efficiency and Stability in Simplified Carbon-Based Perovskite Solar Cells: A Combined Experimental and Theoretical Study

双功能分子桥在简化碳基钙钛矿太阳能电池中提升效率和稳定性的研究：一项结合实验与理论的研究

ACS Applied Energy Materials

IF5.5

2025-07-160

Eco-Friendly and Efficient Semi-Natural Encapsulants Prepared via In Situ Cross-Linking within the Porous Carbon Electrodes of Carbon-Based Perovskite Solar Cells

通过在碳基钙钛矿太阳能电池多孔碳电极中原位交联制备的环保高效半天然封装剂

acs applied engineering materials

IF4.7

2025-03-100

Role of carrier delocalization in enhancing the photostability and defect passivation of 2D/3D hybrid metal halide perovskites

SOLAR ENERGY

IF6.6

2024-12-011

PRE

Role of interaction mode of phenanthrene derivatives as selective PDE5 inhibitors using molecular dynamics simulations and quantum chemical calculations

MOLECULAR DIVERSITY

IF3.8

2024-07-300

PRE

Ligand-Based Virtual Screening for Discovery of Indole Derivatives as Potent DNA Gyrase ATPase Inhibitors Active against Mycobacterium tuberculosis and Hit Validation by Biological Assays

JOURNAL OF CHEMICAL INFORMATION AND MODELING

IF5.3

2024-07-125

OAAI

Comparison of feline and human immunodeficiency virus reverse transcriptase enzymes through chemical screening and computational analysis

CHEMICAL BIOLOGY & DRUG DESIGN

IF3.3

2024-05-090

PRE

Combining Deep Learning and Structural Modeling to Identify Potential Acetylcholinesterase Inhibitors from Hericium erinaceus

ACS OMEGA

IF4.3

2024-03-264

OAAI

Elucidation of benzene sulfonamide derivative binding at a novel interprotomer pocket of wild type and mutants of coxsackievirus B3 viral capsid using molecular dynamics simulations and density functional theory

BIOPHYSICAL CHEMISTRY

IF2.2

2023-11-010

PRE

Combined Deep Learning and Molecular Modeling Techniques on the Virtual Screening of New mTOR Inhibitors from the Thai Mushroom Database

ACS OMEGA

IF4.3

2023-10-024

OAAI

Bioisosteric Design Identifies Inhibitors of Mycobacterium tuberculosis DNA Gyrase ATPase Activity

JOURNAL OF CHEMICAL INFORMATION AND MODELING

IF5.3

2023-04-192

PRE

Development of Aldehyde Functionalized Iridium(III) Complexes Photosensitizers with Strong Visible-Light Absorption for Photocatalytic Hydrogen Generation from Water

开发具有强可见光吸收的醛官能化铱 (III) 配合物光敏剂，用于从水中光催化制氢

INORGANICS

IF3

2023-03-085

Insight into free energy and dynamic cross-correlations of residue for binding affinity of antibody and receptor binding domain SARS-CoV-2

HELIYON

IF3.6

2023-01-012

OAAI

In silico and in vitro studies of potential inhibitors against Dengue viral protein NS5 Methyl Transferase from Ginseng and Notoginseng

JOURNAL OF TRADITIONAL AND COMPLEMENTARY MEDICINE

IF3

2023-01-018

OAAI

Computational design, synthesis and biological evaluation of PDE5 inhibitors based on N2,N4-diaminoquinazoline and N2, N6-diaminopurine scaffolds

BIOORGANIC & MEDICINAL CHEMISTRY

IF3

2022-12-014

PRE

Enhancing the Stability and Performance of Two-Dimensional Perovskite Solar Cells via Double-Step Homogeneous Precursor Mixing

ACS APPLIED ENERGY MATERIALS

IF5.5

2022-09-274

PRE

Development of new thiocyanate-free Ruthenium(II) dyes bearing isoquinoline chromophores for hydrogen production via water splitting

DYES AND PIGMENTS

IF4.2

2022-09-019

PRE

Supa Hannongbua

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