日期:
2020 年 — 2026 年
2020
2021
2022
2023
2024
2025
2026
影响因子:

Chemical tailoring of heteroatom (P, S, Si) doping of COF-PEDOT for adsorption of paracetamol: perspective from DFT studies

通过DFT研究,探讨杂原子(P、S、Si)掺杂COF-PEDOT对扑热息痛吸附的影响

Emeng, Innocent E; Luke, Uduak; Gber, Nguuma I; Ugochukwu, Onyinyechi V; Sundaravadivelu, Ambika; Sampathkumar, Gopinath; Runde, Musa

In silico evaluation of (benzo)chromeno[3,4-c]pyridine derivative as dual EGFR/HER2 inhibitors for non-small cell lung cancer

利用计算机模拟评估(苯并)色烯并[3,4-c]吡啶衍生物作为非小细胞肺癌双重EGFR/HER2抑制剂的疗效

Luke, Uduak; Emeng, Innocent E; Gber, Nguuma I; Iyam, Solomon O

Retraction: Yttrium- and zirconium-decorated Mg(12)O(12)-X (X = Y, Zr) nanoclusters as sensors for diazomethane (CH(2)N(2)) gas

撤稿:钇和锆修饰的Mg(12)O(12)-X (X = Y, Zr)纳米团簇作为重氮甲烷(CH(2)N(2))气体传感器

Gber, Terkumbur E; Louis, Hitler; Ngana, Obinna C; Amodu, Ismail O; Ekereke, Ernest E; Benjamin, Innocent; Adalikwu, Stephen A; Adeyinka, Adedapo

Retraction: Computational design and molecular modeling of the interaction of nicotinic acid hydrazide nickel-based complexes with H(2)S gas

撤稿:烟酸酰肼镍基配合物与硫化氢气体相互作用的计算设计和分子建模

Louis, Hitler; Etiese, Daniel; Unimuke, Tomsmith O; Owen, Aniekan E; Rajee, Abdulahi O; Gber, Terkumbur E; Chima, Chioma M; Eno, Ededet A; Nfor, Emmanuel N

Retraction: Heteroatoms (Si, B, N, and P) doped 2D monolayer MoS(2) for NH(3) gas detection

撤稿:掺杂杂原子(Si、B、N 和 P)的二维单层 MoS₂ 用于 NH₃ 气体检测

Gber, Terkumbur E; Louis, Hitler; Owen, Aniekan E; Etinwa, Benjamin E; Benjamin, Innocent; Asogwa, Fredrick C; Orosun, Muyiwa M; Eno, Ededet A

Retraction notice to "Molecular modeling of the structural, electronic, excited state dynamic, and the photovoltaic properties of the oligomers of n-corannulene (n = 1-4)" [Heliyon 9 (2023) e20706]

撤稿声明:“n-科拉努烯低聚物(n = 1-4)的结构、电子、激发态动力学和光伏性质的分子建模”[Heliyon 9 (2023) e20706]

Hadi, Hamid; Louis, Hitler; Gber, Terkumbur E; Ogungbemiro, Festus O

Catalytic engineering of transition metal (TM: Ni, Pd, Pt)-coordinated Ge-doped graphitic carbon nitride (Ge@g-c3n4) nanostructures for petroleum hydrocarbon separation: An outlook from theoretical calculations

过渡金属(TM:Ni、Pd、Pt)配位的锗掺杂石墨氮化碳(Ge@g-c3n4)纳米结构的催化工程及其在石油烃分离中的应用:理论计算展望

Arikpo, Temple O; Odey, Michael O; Agurokpon, Daniel C; Malu, Daniel G; Gulack, Alpha O; Gber, Terkumbur E

Corrigendum to "Heteroatoms (B, N, S) doped quantum dots as potential drug delivery system for isoniazid: Insight from DFT, NCI, and QTAIM" [Heliyon Vol. 9, Iss. 1, January 2023, Article e12599]

对“杂原子(B、N、S)掺杂量子点作为异烟肼潜在药物递送系统:来自 DFT、NCI 和 QTAIM 的见解”的更正 [Heliyon Vol. 9, Iss. 1, 2023 年 1 月, 文章 e12599]

Edet, Henry O; Louis, Hitler; Gber, Terkumbur E; Idante, Precious S; Idante, Precious S; Egemonye, ThankGod C; Ashishie, Providence B; Oyo-Ita, Emmanuella E; Benjamin, Innocent; Adeyinka, Adedapo S

Yttrium- and zirconium-decorated Mg(12)O(12)-X (X = Y, Zr) nanoclusters as sensors for diazomethane (CH(2)N(2)) gas

钇和锆修饰的Mg(12)O(12)-X (X = Y, Zr)纳米团簇作为重氮甲烷(CH(2)N(2))气体传感器

Gber, Terkumbur E; Louis, Hitler; Ngana, Obinna C; Amodu, Ismail O; Ekereke, Ernest E; Benjamin, Innocent; Adalikwu, Stephen A; Adeyinka, Adedapo

Modeling of magnesium-decorated graphene quantum dot nanostructure for trapping AsH(3), PH(3) and NH(3) gases

利用镁修饰石墨烯量子点纳米结构对AsH₃、PH₃和NH₃气体进行捕获建模

Agwamba, Ernest C; Louis, Hitler; Olagoke, Praise O; Gber, Terkumbur E; Okon, Gideon A; Fidelis, Chidera F; Adeyinka, Adedapo S