| 嘉南藥理大學 |
2023 |
Density Functional Theory Calculations and Molecular Docking Analyses of Flavonoids for Their Possible Application against the Acetylcholinesterase and Triose-Phosphate Isomerase Proteins of Rhipicephalus microplus
|
Malak, Nosheen; Alotaibi, Bader S.; Khan, Afshan; Khan, Adil; Ullah, Shakir; Nasreen, Nasreen; Niaz, Sadaf; Chen, Chien-Chin |
| 國立成功大學 |
2023-04 |
Density Functional Theory Calculations and Molecular Docking Analyses of Flavonoids for Their Possible Application against the Acetylcholinesterase and Triose-Phosphate Isomerase Proteins of Rhipicephalus microplus
|
Malak;Nosheen;Alotaibi;Bader, S.;Khan;Afshan;Khan;Adil;Ullah;Shakir;Nasreen;Nasreen;Niaz;Sadaf;Chen;Chien-Chin |
| 國立中山大學 |
2005 |
Density functional theory calculations of dense TiO2 polymorphs: Implication for visible-light-responsive photocatalysts
|
M.Y. Kuo; C.Y. Hua; H.C. Yang; P.Y. Shen; C.L. Chen |
| 國立臺灣大學 |
1987 |
Density Functional Theory Extensions for Iron Group Ferromagnets
|
蘇德潤; Su, Der-Ruenn |
| 國立成功大學 |
2023-07 |
Density Functional Theory for Buckyballs within Symmetrized Icosahedral Basis
|
Ren;Chung-Yuan;Paudel;Kumar, Raj;Chang;Yia-Chung |
| 東海大學 |
2005 |
Density functional theory of the iron-nitrosyl (S = 3/2) complex
|
Cheng, H.-Y.ab , Chang, S.ab |
| 東海大學 |
2005 |
Density functional theory of the iron-nitrosyl (S = 3/2) complex
|
Cheng, H.-Y.ab , Chang, S.ab |
| 臺大學術典藏 |
2011 |
Density functional theory study of conformation-dependent properties of neutral and radical cationic l -tyrosine and l-tryptophan
|
Kim, S. K.; Lin, S. H.; Hayashi, M.; Fujimura, Y.; Baek, K. Y. |
| 國立交通大學 |
2014-12-08T15:27:38Z |
Density Functional Theory Study of Conformation-Dependent Properties of Neutral and Radical Cationic L-Tyrosine and L-Tryptophan
|
Baek, K. Y.; Fujimura, Y.; Hayashi, M.; Lin, S. H.; Kim, S. K. |
| 國立臺灣科技大學 |
2010 |
Density Functional Theory Study of Ethanol Decomposition on 3Ni/alpha-Al2O3(0001) Surface
|
Chiang, H.N.;Wang, C.C.;Cheng, Y.C.;Jiang, J.C.;Hsieh, H.M. |
| 國立成功大學 |
2022-07-31 |
Density functional theory study of hydrogen as reducing agent of hematite (?-Fe2O3) in ironmaking process
|
Huang;Yan-Jia;Kaun;Chao-Cheng;Su;Yen-Hsun |
| 國立成功大學 |
2022 |
Density functional theory study of hydrogen as reducing agent of hematite (α-Fe2O3) in ironmaking process
|
Huang, Y.-J.;Kaun, C.-C.;Su, Y.-H. |
| 國立臺灣科技大學 |
2010 |
Density Functional Theory Study of NHx (x=0-3) and N-2 Adsorption on IrO2(110) Surfaces
|
Wang, C.C.;Siao, S.S.;Jiang, J.C. |
| 國立交通大學 |
2015-07-21T08:28:32Z |
Density Functional Theory Study of Pt3M Alloy Surface Segregation with Adsorbed O/OH and Pt3Os as Catalysts for Oxygen Reduction Reaction
|
Tsai, Ho-Cheng; Yu, Ted H.; Sha, Yao; Merinov, Boris V.; Wu, Pu-Wei; Chen, San-Yuan; Goddard, William A., III |
| 國立交通大學 |
2014-12-08T15:08:14Z |
Density Functional Theory Study of the Adsorption and Reaction of H(2)S on TiO(2) Rutile (110) and Anatase (101) Surfaces
|
Huang, Wen-Fei; Chen, Hsin-Tsung; Lin, M. C. |
| 國立交通大學 |
2019-04-02T05:58:47Z |
Density Functional Theory Study of the Adsorption and Reaction of H2S on TiO2 Rutile (110) and Anatase (101) Surfaces
|
Huang, Wen-Fei; Chen, Hsin-Tsung; Lin, M. C. |
| 修平科技大學 |
2002 |
Density Functional Theory Study of the Internal Rotational Barriers of Some Aromatic Nitro Compounds
|
P.C. Chen;Y.C. Chieh |
| 國立臺灣科技大學 |
2009 |
Density Functional Theory Study of the Oxidation of Ammonia on RuO2(110) Surface
|
Wang, C.C.;Yang, Y.J.;Jiang, J.C.;Tsai, D.S.;Hsieh, H.M. |
| 國立臺灣科技大學 |
2011 |
Density Functional Theory Study of the Oxidation of Ammonia on the IrO2(110) Surface
|
Wang, C.C.;Siao, S.S.;Jiang, J.C. |
| 國立臺灣科技大學 |
2013 |
Density functional theory study of water-gas-shift reaction on 3Cu/α-Al2O3(0001) surface
|
Chiang, H.-N.;Jiang, J.-C. |
| 國立臺灣科技大學 |
2019 |
Density functional theory study on the adsorption of alkali metal ions with pristine and defected graphene sheet
|
Sangavi, Sangavi S.;Santhanamoorthi, N.;Vijayakumar, S. |
| 國立臺灣大學 |
2012-04 |
Density functional theory with fractional orbital occupations
|
Chai, Jeng-Da |
| 臺大學術典藏 |
2018-09-10T09:16:45Z |
Density functional theory with fractional orbital occupations
|
Chai, Jeng-Da; JENG-DA CHAI |
| 國立成功大學 |
2019 |
Density functional theory-based modeling and calculations of a polyamide molecular unit for studying forward-osmosis-dewatering of microalgae
|
Itliong, J.N.;Rojas, K.I.M.;Ubando, A.T.;Chen, W.-H.;Villagracia, A.R.C.;David, M.Y.;Culaba, A.B.;Ong, H.L.;Moreno, J.L.V.;Manrique, R.B.;Chang, J.-S.;Kasai, H.;Bernardo, G.P.O.;Padama, A.A.B.;Arboleda, N.B. |
| 淡江大學 |
2004-03 |
Density functonal study of XH4 (X =Si and Ge) ractivity upon dissociative adsorption onto Si(100) surface
|
Lin, Jyh-shing; Lee, Lien-Feng |
