ผศ.ดร.มาลินี พรหมขัติแก้ว

Physical Chemistry and Computational Chemistry

1. Malinee Promkatkaew, Pornthip Boonsri, Songwut Suramitr, Peter Wolschann, Supa Hannongbua, 2023 Stability improvement of UV-filter between methoxy cinnamic acid derivatives and cyclodextrins inclusion complexes based on DFT and TD-DFT investigations. Journal of Molecular Graphics and Modelling, 2023, 125, 108619
2. Ketsarin Chantarasunthon, Malinee Promkatkaew, Patthreera Waranwongcharoen, Anek Sueksachat, Nitchanan Prasop, Thanaporn Norasi, Narisa Sonsiri, Sirirat Sansern, Sinchai Chomngam, Kanokorn Wechakorn, Chanat Thana, Wissawat Sakulsaknimitr, Palangpon Kongsaeree, Pailin Srisuratsiri. 2023. A novel highly selective FRET sensor for Fe(III) and DFT mechanistic evaluation, Spectrochimica Acta – Part A: Molecular and Biomolecular Spectroscopy, 286, 122031
3. Malinee Promkatkaew, Sunan Kitjaruwankul, Supaporn Baiya, Suree Tongwanichniyom, Pornthip Boonsri, and Supa Hannongbua, 2022, A DFT-based Analysis of Metals Adsorption on Chitosan Monomer SWU Sci. J. Vol. 38 No. 2, 37-47.
4. Malinee Promkatkaew, Laksamee Chaicharoenwimolkul Chuaitammakit, Kitiya Naree Jinnapus Sillapa, and Sopanat Kongsriprapan, 2022, A Highly Sensitive and Selective Fluorescent Probe for the Detection of Cerium(III) Using Tridentate Based-Oxazolidine: Experimental and DFT Investigations Journal of Fluorescence, 33(1), 145-152.
5. Malinee Promkatkaew, Songwut Suramitr, Thitinun Karpkird, Masahiro Ehara, and Supa Hannongbua, 2020, DFT/TD-DFT investigation on the photoinduced electron transfer of diruthenium and viologen complexes, Journal of Luminescence, 222, 117121.
6. Kanokwan Chaichana, Napha Phutlaprungrueang, Laksamee Chaicharoenwimolkul, Malinee Promkatkaew, Sopanat Kongsriprapan, 2019, A selective fluorescence probe based on naphthalene for the detection of barium(II). Spectrochimica Acta – Part A: Molecular and Biomolecular Spectroscopy, 207,118-122.
7. Malinee Promkatkaew, Pornthip Boonsri, and Supa Hannongbua, 2019, Structural and Spectroscopic Properties of Metal Complexes with Ruhemann’s Purple Compounds Calculated using Density Functional Theory, Key Engineering Materials, 824, 204-211. (DOI:
8. Suppamat Makjan, Malinee Promkatkaew, Supa Hannongbua, and Pornthip Boonsri, 2019, Theoretical Study of the Electronic Structure and Properties of Alternating Donor-Acceptor Couples of Carbazole-Based Compounds for Advanced Organic Light-Emitting Diodes (OLED), Key Engineering Materials, 824, 236-244.
9. Malinee Promkatkaew, Patchanee Tiemkeeree, Sakunrat Chansamon, Chanoknun Thakrabao, and Songwut Suramitr. 2017, Theoretical Study on the Structural and Spectroscopic Properties of Cyanine Dyes as Fluorescent Dyes. Journal of Science and Technology Ubon Ratchathani University (JST-UBU). 42-46.
10. Malinee Promkatkaew, Songwut Suramitr, Thitinun Karpkird, Supason Wanichweacharungrang, Masahiro Ehara, and Supa Hannongbua. 2014, Photophysical and Photochemical Properties of the Substituted Cinnamates and Cinnamic Acids for UVB Blocking Function: Effect of Hydroxy, Nitro, and Fluoro Substitutions at ortho-, meta-, and para-Positions. Photochemical and Photobiological Sciences, 13, 583-594.
11. Malinee Promkatkaew, Duangkamol Gleeson, Supa Hannongbua and M. Paul Gleeson, 2014, Skin Sensitization Prediction Using Quantum Chemical Calculations: A Theoretical Model for the SNAr Domain. Chemical Research in Toxicology, 27, 51−60
12. Malinee Promkatkaew, Songwut Suramitr, Thitinun Karpkird, Masahiro Ehara, and Supa Hannongbua. 2013, Absorption and Emission Properties of Various Substituted Cinnamic Acids and Cinnamates, Based on TDDFT Investigation. International Journal of Quantum Chemistry, 113, 542–554.
13. M. Paul Gleeson, Sandeep Modi, Andreas Bender, Richard L. Marcese Robinson, Johannes Kirchmair, Malinee Promkatkaew, Supa Hannongbua and Robert C. Glen. 2012, The Challenges Involved in Modeling Toxicity Data In Silico: A Review. Current Pharmaceutical Design, 18, 1266–1291.
14. Masahiro Ehara, Lu Yun-peng, Malinee Promkatkaew, and Supa Hannongbua. 2012, Electronic Structure and Optical Properties of Conjugated Molecules: SAC-CI Study. International Conference of Computational Methods in Sciences and Engineering 2009, AIP Conf. Proc. 1504, 848-851.
15. Masahiro Ehara, Biswajit Saha, Potjaman Poolmee, Malinee Promkatkaew, Supa Hannongbua, Yun-peng Lu, and Hiroshi Nakatsuji. 2012, Electronic Structure and Optical Properties of Conjugated Molecules: SAC-CI Study. International Conference of Computational Methods in Sciences and Engineering 2009, AIP Conf. Proc. 1504, 279-290.
16. Malinee Promkatkaew, Songwut Suramitr, Thitinun Monhaphol Karpkird, Supawadee Namuangruk, Masahiro Ehara, and Supa Hannongbua. 2009, Absorption and Emission Spectra of UVB Blocking Methoxy Substituted Cinnamates Investigated Using the Symmetry-Adapted Cluster Configuration Interaction Method. Journal of Chemical Physics. 131, 224309-1-10