modeling studies Latest Research Papers

Impact of acid wormhole on the mechanical properties of chalk, limestone, and dolomite: Experimental and modeling studies

Energy Reports ◽

10.1016/j.egyr.2021.11.249 ◽

2022 ◽

Vol 8 ◽

pp. 605-616

Author(s):

Ayyaz Mustafa ◽

Taqi Alzaki ◽

Murtada Saleh Aljawad ◽

Theis Solling ◽

Jack Dvorkin

Keyword(s):

Mechanical Properties ◽

Modeling Studies

Experimental and kinetic modeling studies of 2-acetylfuran pyrolysis at atmospheric pressure

Combustion and Flame ◽

10.1016/j.combustflame.2021.111824 ◽

2022 ◽

Vol 236 ◽

pp. 111824

Author(s):

Wei He ◽

Qiang Xu ◽

Cheng Xie ◽

Jiuzheng Yin ◽

Peidong Li ◽

...

Keyword(s):

Kinetic Modeling ◽

Atmospheric Pressure ◽

Modeling Studies

Spectroscopic characterization of Cu(II), Ni(II), Co(II) complexes, and nano copper complex bearing a new S, O, N-donor chelating ligand. 3D modeling studies, antimicrobial, antitumor, and catalytic activities

Journal of Molecular Structure ◽

10.1016/j.molstruc.2021.131587 ◽

2022 ◽

Vol 1249 ◽

pp. 131587

Author(s):

Mosad A. El-ghamry ◽

Magdy Shebl ◽

Akila A. Saleh ◽

Saied M.E. Khalil ◽

Magdah Dawy ◽

...

Keyword(s):

Copper Complex ◽

3D Modeling ◽

Spectroscopic Characterization ◽

Catalytic Activities ◽

Modeling Studies ◽

Chelating Ligand

Fish Farms Effluents for Irrigation and Fertilizer: Field and Modeling Studies

Climate-Smart Agriculture ◽

10.1007/978-3-030-93111-7_3 ◽

2022 ◽

pp. 43-66

Author(s):

Abd El-Hafeez Zohry ◽

Samiha Ouda

Keyword(s):

Fish Farms ◽

Modeling Studies

Molecular structural investigations of quinoxaline derivatives through 3D-QSAR, molecular docking, ADME prediction and pharmacophore modeling studies for the search of novel antimalarial agent

Journal of the Indian Chemical Society ◽

10.1016/j.jics.2022.100343 ◽

2022 ◽

pp. 100343

Author(s):

Achal Mishra ◽

Vibhu Jha ◽

Harish Rajak

Keyword(s):

Molecular Docking ◽

3D Qsar ◽

Pharmacophore Modeling ◽

Structural Investigations ◽

Antimalarial Agent ◽

Adme Prediction ◽

Modeling Studies ◽

Quinoxaline Derivatives

Multiscale modeling studies for exploring lignocellulosic biomass structure

10.1016/b978-0-12-823827-1.00010-9 ◽

2022 ◽

pp. 257-289

Author(s):

Veerapandian Ponnuchamy

Keyword(s):

Lignocellulosic Biomass ◽

Multiscale Modeling ◽

Biomass Structure ◽

Modeling Studies

Discovery of tetrahydro-β-carboline- and indole-based derivatives as promising phosphodiesterase-4 inhibitors: Synthesis, biological evaluation, and molecular modeling studies

Journal of Molecular Structure ◽

10.1016/j.molstruc.2021.131491 ◽

2022 ◽

Vol 1248 ◽

pp. 131491

Author(s):

Khaled M. Darwish ◽

Ahmad Abdelwaly ◽

Asmaa M. Atta ◽

Mohamed A. Helal

Keyword(s):

Molecular Modeling ◽

Biological Evaluation ◽

Phosphodiesterase 4 ◽

Modeling Studies ◽

Phosphodiesterase 4 Inhibitors ◽

Molecular Modeling Studies

Experimental and Modeling Studies of Torrefaction of Spent Coffee Grounds and Coffee Husk: Effects on Surface Chemistry and Carbon Dioxide Capture Performance

ACS Omega ◽

10.1021/acsomega.1c05270 ◽

2021 ◽

Author(s):

Alivia Mukherjee ◽

Jude A. Okolie ◽

Catherine Niu ◽

Ajay K. Dalai

Keyword(s):

Carbon Dioxide ◽

Surface Chemistry ◽

Carbon Dioxide Capture ◽

Spent Coffee Grounds ◽

Coffee Husk ◽

Modeling Studies ◽

Coffee Grounds

Equilibrium, thermodynamic, and kinetic modeling studies for the adsorptive removal of oxyanions from water

Separation Science and Technology ◽

10.1080/01496395.2021.2009869 ◽

2021 ◽

pp. 1-16

Author(s):

Ranjhan Junejo ◽

Nida Shams Jalbani ◽

Savas Kaya ◽

Goncagül Serdaroglu ◽

Mustafa Elik ◽

...

Keyword(s):

Kinetic Modeling ◽

Equilibrium Thermodynamic ◽

Adsorptive Removal ◽

Modeling Studies

Novel fluoroquinolones containing 2‐arylamino‐2‐oxoethyl fragment: Design, synthesis, evaluation of antibacterial and antituberculosis activities and molecular modeling studies

Journal of Heterocyclic Chemistry ◽

10.1002/jhet.4430 ◽

2021 ◽

Author(s):

Necla Kulabaş ◽

Aslı Türe ◽

Arif Bozdeveci ◽

Vagolu Siva Krishna ◽

Şengül Alpay Karaoğlu ◽

...

Keyword(s):

Molecular Modeling ◽

Design Synthesis ◽

Modeling Studies ◽

Molecular Modeling Studies

modeling studies
Recently Published Documents

TOTAL DOCUMENTS

H-INDEX

Impact of acid wormhole on the mechanical properties of chalk, limestone, and dolomite: Experimental and modeling studies

Experimental and kinetic modeling studies of 2-acetylfuran pyrolysis at atmospheric pressure

Spectroscopic characterization of Cu(II), Ni(II), Co(II) complexes, and nano copper complex bearing a new S, O, N-donor chelating ligand. 3D modeling studies, antimicrobial, antitumor, and catalytic activities

Fish Farms Effluents for Irrigation and Fertilizer: Field and Modeling Studies

Molecular structural investigations of quinoxaline derivatives through 3D-QSAR, molecular docking, ADME prediction and pharmacophore modeling studies for the search of novel antimalarial agent

Multiscale modeling studies for exploring lignocellulosic biomass structure

Discovery of tetrahydro-β-carboline- and indole-based derivatives as promising phosphodiesterase-4 inhibitors: Synthesis, biological evaluation, and molecular modeling studies

Experimental and Modeling Studies of Torrefaction of Spent Coffee Grounds and Coffee Husk: Effects on Surface Chemistry and Carbon Dioxide Capture Performance

Equilibrium, thermodynamic, and kinetic modeling studies for the adsorptive removal of oxyanions from water

Novel fluoroquinolones containing 2‐arylamino‐2‐oxoethyl fragment: Design, synthesis, evaluation of antibacterial and antituberculosis activities and molecular modeling studies

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modeling studiesRecently Published Documents

TOTAL DOCUMENTS

H-INDEX

Impact of acid wormhole on the mechanical properties of chalk, limestone, and dolomite: Experimental and modeling studies

Experimental and kinetic modeling studies of 2-acetylfuran pyrolysis at atmospheric pressure

Spectroscopic characterization of Cu(II), Ni(II), Co(II) complexes, and nano copper complex bearing a new S, O, N-donor chelating ligand. 3D modeling studies, antimicrobial, antitumor, and catalytic activities

Fish Farms Effluents for Irrigation and Fertilizer: Field and Modeling Studies

Molecular structural investigations of quinoxaline derivatives through 3D-QSAR, molecular docking, ADME prediction and pharmacophore modeling studies for the search of novel antimalarial agent

Multiscale modeling studies for exploring lignocellulosic biomass structure

Discovery of tetrahydro-β-carboline- and indole-based derivatives as promising phosphodiesterase-4 inhibitors: Synthesis, biological evaluation, and molecular modeling studies

Experimental and Modeling Studies of Torrefaction of Spent Coffee Grounds and Coffee Husk: Effects on Surface Chemistry and Carbon Dioxide Capture Performance

Equilibrium, thermodynamic, and kinetic modeling studies for the adsorptive removal of oxyanions from water

Novel fluoroquinolones containing 2‐arylamino‐2‐oxoethyl fragment: Design, synthesis, evaluation of antibacterial and antituberculosis activities and molecular modeling studies

modeling studies
Recently Published Documents