Molecular Modeling; Meps Maps; Orbital Frontier; Quantum Chemical Methods - Articles

Quantum of the Magnetic Flux Characteristic forExperiments Performed on the Integer and Fractional Quantum Hall Effects (Articles)

Stanisław Olszewski

Journal of Modern Physics Vol.4 No.11A，November 19, 2013

DOI: 10.4236/jmp.2013.411A1003 4,037 Downloads 6,053 Views Citations
This article belongs to the Special Issue on Advances in Quantum Physics
Photoionization Study of the 2s²2p² (¹D)ns(²D), 2s²2p² (¹D)nd(²P), 2s²2p² (¹D)nd(²S), 2s²2p² (¹S)nd²D, and 2s²2p³ (³P)np(²D) Rydberg Series of O+ Ions via the Modified Atomic Orbital Theory (Articles)

Malick Sow, Fatou Ndoye, Alassane Traoré, Abdou Diouf, Boubacar Sow, Youssou Gning, Papa Amadou Lamine Diagne

Journal of Modern Physics Vol.12 No.10，August 18, 2021

DOI: 10.4236/jmp.2021.1210086 235 Downloads 747 Views Citations
Modified Atomic Orbital Theory of the O⁺ Ion Originating from 2D⁰ and 4S⁰ Metastable States (Articles)

Malick Sow, Fatou Ndoye, Babou Diop, Alassane Traoré, Abdou Diouf, Boubacar Sow

Journal of Applied Mathematics and Physics Vol.10 No.6，June 7, 2022

DOI: 10.4236/jamp.2022.106128 142 Downloads 587 Views Citations
An Alternative Model of Proton and Neutron (Articles)

Arend Niehaus

Journal of Modern Physics Vol.11 No.2，February 20, 2020

DOI: 10.4236/jmp.2020.112017 556 Downloads 1,332 Views Citations
Mathematical Apparatus for Selection of Optimal Parameters of Technical, Technological Systems and Materials Based on Vector Optimization (Articles)

Yu Mashunin

American Journal of Operations Research Vol.10 No.5，September 27, 2020

DOI: 10.4236/ajor.2020.105013 488 Downloads 1,196 Views Citations
Study of Dielectric and Piezoelectric Properties in the Ternary System Pb_0.98Ca_0.02[{(Zr_0.52Ti_0.48)_0.98(Cr³⁺_0.5 , Ta⁵⁺_0.5)_0.02}_1–zP_z]O₃ Doping Effects (Articles)

Hamzioui Louanes, Kahoul Fares, Abdessalem Nora, Boutarfaia Ahmed

Materials Sciences and Applications Vol.3 No.1，January 12, 2012

DOI: 10.4236/msa.2012.31007 4,162 Downloads 7,334 Views Citations
The Complementarity Effect for Cdc25 Phosphatase Inhibitors (Articles)

Wassila Soufi, Meriem Merad, Faïza Boukli, Saïd Ghalem

Advances in Molecular Imaging Vol.1 No.2，August 5, 2011

DOI: 10.4236/ami.2011.12003 4,827 Downloads 14,488 Views Citations
Computer-Aided Drug Design: An Innovative Tool for Modeling (Articles)

Pranita P. Kore, Madhavi M. Mutha, Rishikesh V. Antre, Rajesh J. Oswal, Sandip S. Kshirsagar

Open Journal of Medicinal Chemistry Vol.2 No.4，December 31, 2012

DOI: 10.4236/ojmc.2012.24017 28,289 Downloads 41,559 Views Citations
Moderated PEF from Transitioning between the Micro and Macroscopic Usage of Coulomb’s Law (Articles)

Eve G. Zoebisch

Computational Chemistry Vol.3 No.1，January 16, 2015

DOI: 10.4236/cc.2015.31002 3,237 Downloads 4,677 Views Citations
Synthesis of Pyrroles and Condensed Pyrroles as Anti-Inflammatory Agents with Multiple Activities and Their Molecular Docking Study (Articles)

M. T. Sarg, M. M. Koraa, A. H. Bayoumi, S. M. Abd El Gilil

Open Journal of Medicinal Chemistry Vol.5 No.4，November 13, 2015

DOI: 10.4236/ojmc.2015.54005 5,458 Downloads 8,000 Views Citations
The Locus PgaABCD of Acinetobacter junii Putatively Responsible for Poly-β-(1,6)-N-Acetylglucosamine Biosynthesis Might Be Related to Biofilm Formation: A Computational Analysis (Articles)

Bipransh Kumar Tiwary, Arvind Kumar, Ravi Kant Pathak, Nishtha Pandey, Krishna Kant Yadav, Ranadhir Chakraborty

Advances in Microbiology Vol.6 No.3，March 31, 2016

DOI: 10.4236/aim.2016.63022 2,315 Downloads 3,385 Views Citations
This article belongs to the Special Issue on Research on Gram Bacteria
Role of the Metabolic Minor Components in the Regulation of Intermolecular Interaction (Articles)

Frida Gilmiyarova, Nataliya Kolotyeva, Viktoriya Radomskaya, Oksana Gusyakova, Irina Gorbacheva, Valeriya Potekhina

Journal of Biosciences and Medicines Vol.4 No.7，July 8, 2016

DOI: 10.4236/jbm.2016.47004 1,569 Downloads 2,424 Views Citations
Designing General Anesthetics That Have a Better Safety Profile (Articles)

Robert B. Raffa, Joseph V. Pergolizzi Jr., Robert Taylor Jr.

Pharmacology & Pharmacy Vol.10 No.10，October 11, 2019

DOI: 10.4236/pp.2019.1010033 894 Downloads 1,972 Views Citations
Synthesis, Spectroscopic, Molecular Modeling and Anti-Fungal Studies of Some Divalent Metal Complexes of 4-Hydroxyacetophenone Isonicotinoyl Hydrazone (Articles)

Gwendoline M. Toh-Boyo, Romanus N. Njong, Estella M. Babette, Emmanuel N. Nfor

Open Journal of Inorganic Chemistry Vol.11 No.3，July 26, 2021

DOI: 10.4236/ojic.2021.113007 422 Downloads 1,908 Views Citations
Particle Modeling Based on Interatomic Potential and Crystal Structure: A Multi-Scale Simulation of Elastic-Plastic Deformation of Metallic Material (Articles)

Ken-Ichi Saitoh, Naoya Hanashiro

World Journal of Nano Science and Engineering Vol.11 No.3，August 17, 2021

DOI: 10.4236/wjnse.2021.113003 433 Downloads 1,411 Views Citations
In Silico Exploration of New Inhibitors of Protein Kinases Containing an N-Phenylbenzamide Linker: A Combination of Docking and Molecular Dynamics Modeling, Pharmacophore Modeling and Virtual Screening (Articles)

Aliaksandr Faryna, Elena Kalinichenko

Open Journal of Medicinal Chemistry Vol.15 No.1，March 28, 2025

DOI: 10.4236/ojmc.2025.151001 35 Downloads 171 Views Citations
Molecular Dynamics Study on Mechanical Properties in the Structure of Self-Assembled Quantum Dot (Articles)

Tatsuya Yamaguchi, Ken-ichi Saitoh

World Journal of Nano Science and Engineering Vol.2 No.4，December 14, 2012

DOI: 10.4236/wjnse.2012.24025 5,341 Downloads 7,963 Views Citations
Psychiatry: Looking to the Future (Articles)

Massimo Cocchi

Open Journal of Depression Vol.4 No.4，November 24, 2015

DOI: 10.4236/ojd.2015.44007 3,905 Downloads 5,225 Views Citations
Chiral Recognition of Dansyl Derivatives with an Amino Acid-Based Molecular Micelle: A Molecular Dynamics Investigation (Articles)

Mauro Garcia, Nathan Black, Eugene Billiot, Fereshteh Billiot, Kevin F. Morris, Yayin Fang

Open Journal of Physical Chemistry Vol.11 No.2，May 26, 2021

DOI: 10.4236/ojpc.2021.112004 360 Downloads 1,268 Views Citations
An Augmented Framework for Formal Analysis of Safety Critical Systems (Articles)

Monika Singh, V. K. Jain

Journal of Software Engineering and Applications Vol.10 No.8，July 11, 2017

DOI: 10.4236/jsea.2017.108039 1,280 Downloads 2,743 Views Citations

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