Ушбу иш иқтибос қилган ишлар

41 та иш

Иш: DFT Insights into the Adsorption Mechanisms and Electronic Modulation of α-Phographene Toward Metal and Molecular Species: From Physisorption to Quasi Covalent Binding

Multiwfn: A multifunctional wavefunction analyzer
Tian Lu, Feiwu Chen
Мақола2011110 иқтибос
ABI
VMD: Visual molecular dynamics
William Humphrey, Andrew Dalke, Klaus Schulten
Мақола199677 иқтибос
ABI
Sustainable technologies for water purification from heavy metals: review and analysis
Sreenath Bolisetty, Mohammad Peydayesh, Raffaele Mezzenga
Шарҳ мақола20197 иқтибос
ABI
Highly efficient and regenerable amine-impregnated adsorbents: Mechanistic insights into glycerol modification for enhanced direct air capture
Feng Yan, Heijin Chen, Tong Chi +5
Мақола20256 иқтибос
ABI
A Review of Removal of Pollutants from Water/Wastewater Using Different Types of Nanomaterials
Muhammad Tahir Amin, A. A. Alazba, Umair Manzoor
Шарҳ мақола20146 иқтибос
ABI
Investigating the adsorption, electronic properties, and gas-sensing responses of NH3 on the B3S monolayer
Mohamed J. Saadh, Sura Mohammad Mohealdeen, Nelly Esther Flores Tapia +5
Мақола20236 иқтибос
ABI
The B3S monolayer as a two-dimensional material for seeing of HCHO molecules as environmental and water pollutants
Yuan Li, Yu Fang, Weiqing Ning +6
Мақола20246 иқтибос
ABI
Noncovalent Interactions in Crystalline Picolinic Acid N-Oxide: Insights from Experimental and Theoretical Charge Density Analysis
Anastasia V. Shishkina, Vladimir Zhurov, A.I. Stash +3
Мақола20136 иқтибос
ABI
Heavy metal removal from water/wastewater by nanosized metal oxides: A review
Ming Hua, Shujuan Zhang, Bingcai Pan +3
Шарҳ мақола20115 иқтибос
ABI
Role of nanomaterials as adsorbents in heavy metal ion removal from waste water: A review
Shweta Wadhawan, Ayushi Jain, Jasamrit Nayyar +1
Шарҳ мақола20195 иқтибос
ABI
Selective Sensing Characteristics of Ca Doped BeO Nano-sized Tube toward H2O and NH3
Maziar Noei, Vahid Zare-Shahabadi, Seyedeh Najmeh Razi
Мақола20134 иқтибос
ABI
DFT analysis on the removal of dimethylbenzoquinones in atmosphere and water environments: ·OH-initiated oxidation and captured by (TiO2)n clusters (n=1–6)
Feng‐Yang Bai, Shuang Ni, Yu Ren +3
Мақола20194 иқтибос
ABI
Electron/Hole Mobilities of Periodic DNA and Nucleobase Structures from Large-Scale DFT Calculations
Hyuna Kwon, Anshuman Kumar, Mauro Del Ben +1
Мақола20234 иқтибос
ABI
A DFT/TD-DFT investigation of clozapine adsorption on B 12 Y 12 (Y = N, P) nanocages as vehicles for applications in schizophrenia treatment
Charly Tedjeuguim Tsapi, Stanley Numbonui Tasheh, Aymard Didier Tamafo Fouégué +4
Мақола20254 иқтибос
ABI
Health Risks and Benefits of Seafood Consumption
James H. Diaz, Chih‐Yang Hu
Мақола20093 иқтибос
ABI
Risks of Copper and Iron Toxicity during Aging in Humans
George J. Brewer
Шарҳ мақола20093 иқтибос
ABI
Substituent effect on the cell voltage of nanographene based Li-ion batteries: A DFT study
Xiaomao Wu, Zhenxing Zhang, Hamed Soleymanabadi
Мақола20193 иқтибос
ABI
Charge transfer and nonlinear optical properties of anthraquinone D-π-A dyes in relation with the DFT based molecular descriptors and perturbational potential
Nitesh N. Ayare, Vandana Kumari Shukla, Nagaiyan Sekar
Мақола20203 иқтибос
ABI
Theoretical calculations of molecular descriptors for anticancer activities of 1, 2, 3-triazole-pyrimidine derivatives against gastric cancer cell line (MGC-803): DFT, QSAR and docking approaches
Rhoda Oyeladun Oyewole, Abel Kolawole Oyebamiji, Banjo Semire
Мақола20203 иқтибос
ABI
Heavy metal in drinking water its effect on human health and its treatment techniques – a review
Шарҳ мақола20183 иқтибос
ABI
Self‐Reinforced Bimetallic Mito‐Jammer for Ca 2+ Overload‐Mediated Cascade Mitochondrial Damage for Cancer Cuproptosis Sensitization
Chier Du, Xun Guo, Xiaoling Qiu +15
Мақола20243 иқтибос
ABI
Machine learning prediction of hydrochar adsorption capacity for methylene blue with limited data: Inspired by generative adversarial network-based augmentation
Chong Liu, Jingxian An, Xuan Cuong Nguyen +1
Мақола20253 иқтибос
ABI
Synthesis and Application of Highly Active Dithiooxamide Functionalised Multi-Walled Carbon Nanotubes Toward Mercury Removal from Aqueous Solution
Mirabi Ali, Shokuhi Rad Ali, Siadati Seyyed Amir +1
Мақола20162 иқтибос
ABI
A study of dose response and organ susceptibility of copper toxicity in a rat model
Vijay Kumar, Jayantee Kalita, U. K. Misra +1
Мақола20142 иқтибос
ABI
Liver pathology in Wilson's disease: From copper overload to cirrhosis
Clara Gerosa, Daniela Fanni, Terenzio Congiu +4
Шарҳ мақола20192 иқтибос
ABI

Ушбу иш иқтибос қилган ишлар

Multiwfn: A multifunctional wavefunction analyzer

VMD: Visual molecular dynamics

Sustainable technologies for water purification from heavy metals: review and analysis

Highly efficient and regenerable amine-impregnated adsorbents: Mechanistic insights into glycerol modification for enhanced direct air capture

A Review of Removal of Pollutants from Water/Wastewater Using Different Types of Nanomaterials

Investigating the adsorption, electronic properties, and gas-sensing responses of NH3 on the B3S monolayer

The B3S monolayer as a two-dimensional material for seeing of HCHO molecules as environmental and water pollutants

Noncovalent Interactions in Crystalline Picolinic Acid N-Oxide: Insights from Experimental and Theoretical Charge Density Analysis

Heavy metal removal from water/wastewater by nanosized metal oxides: A review

Role of nanomaterials as adsorbents in heavy metal ion removal from waste water: A review

Selective Sensing Characteristics of Ca Doped BeO Nano-sized Tube toward H2O and NH3

DFT analysis on the removal of dimethylbenzoquinones in atmosphere and water environments: ·OH-initiated oxidation and captured by (TiO2)n clusters (n=1–6)

Electron/Hole Mobilities of Periodic DNA and Nucleobase Structures from Large-Scale DFT Calculations

A DFT/TD-DFT investigation of clozapine adsorption on B <sub>12</sub> Y <sub>12</sub> (Y = N, P) nanocages as vehicles for applications in schizophrenia treatment

Health Risks and Benefits of Seafood Consumption

Risks of Copper and Iron Toxicity during Aging in Humans

Substituent effect on the cell voltage of nanographene based Li-ion batteries: A DFT study

Charge transfer and nonlinear optical properties of anthraquinone D-π-A dyes in relation with the DFT based molecular descriptors and perturbational potential

Theoretical calculations of molecular descriptors for anticancer activities of 1, 2, 3-triazole-pyrimidine derivatives against gastric cancer cell line (MGC-803): DFT, QSAR and docking approaches

Heavy metal in drinking water its effect on human health and its treatment techniques – a review

Self‐Reinforced Bimetallic Mito‐Jammer for Ca <sup>2+</sup> Overload‐Mediated Cascade Mitochondrial Damage for Cancer Cuproptosis Sensitization

Machine learning prediction of hydrochar adsorption capacity for methylene blue with limited data: Inspired by generative adversarial network-based augmentation

Synthesis and Application of Highly Active Dithiooxamide Functionalised Multi-Walled Carbon Nanotubes Toward Mercury Removal from Aqueous Solution

A study of dose response and organ susceptibility of copper toxicity in a rat model

Liver pathology in Wilson's disease: From copper overload to cirrhosis