Login
Login
切换导航
Home
Articles
Journals
Books
News
About
Services
Submit
Home
Journal
Articles
Journals A-Z
Browse Subjects
Biomedical & Life Sci.
Business & Economics
Chemistry & Materials Sci.
Computer Sci. & Commun.
Earth & Environmental Sci.
Engineering
Medicine & Healthcare
Physics & Mathematics
Social Sci. & Humanities
Browse Subjects
Biomedical & Life Sciences
Business & Economics
Chemistry & Materials Science
Computer Science & Communications
Earth & Environmental Sciences
Engineering
Medicine & Healthcare
Physics & Mathematics
Social Sciences & Humanities
Publish with us
Paper Submission
Information for Authors
Peer-Review Resources
Open Special Issues
Open Access Statement
Frequently Asked Questions
Publish with us
Paper Submission
Information for Authors
Peer-Review Resources
Open Special Issues
Open Access Statement
Frequently Asked Questions
Follow SCIRP
Contact us
+1 323-425-8868
customer@scirp.org
+86 18163351462(WhatsApp)
1655362766
Paper Publishing WeChat
Complete Matching
Editorial Board
Show/Hide Options
Show/Hide Options
All
Title
Abstract
Keywords
DOI
Author
Journal
Affiliation
ISSN
Subject
A DFT/ECP-Small Basis Set Modelling of Cisplatin: Molecular Structure and Vibrational Spectrum
(Articles)
Nicolay I. Dodoff
Computational Molecular Bioscience
Vol.2 No.2
,June 29, 2012
DOI:
10.4236/cmb.2012.22004
6,490
Downloads
16,767
Views
Citations
A Comparative Study on the Structural and Vibrational Properties of Two Potential Antimicrobial and Anticancer Cyanopyridine Derivatives
(Articles)
María J. Márquez
,
María B. Márquez
,
Pablo G. Cataldo
,
Silvia A. Brandán
Open Journal of Synthesis Theory and Applications
Vol.4 No.1
,January 8, 2015
DOI:
10.4236/ojsta.2015.41001
4,243
Downloads
5,659
Views
Citations
Synthesis, Structural Study and Spectroscopic Characterization of a Quinolin-8-Yloxy Derivative with Potential Biological Properties
(Articles)
Elida Romano
,
María V. Castillo
,
Jorgelina L. Pergomet
,
Juan Zinczuk
,
Silvia A. Brandán
Open Journal of Synthesis Theory and Applications
Vol.2 No.1
,January 28, 2013
DOI:
10.4236/ojsta.2013.21002
4,791
Downloads
9,056
Views
Citations
On the Accuracy of the Complete Basis Set Extrapolation for Anionic Systems: A Case Study of the Electron Affinity of Methane
(Articles)
Alejandro Ramírez-Solís
Computational Chemistry
Vol.2 No.2
,April 29, 2014
DOI:
10.4236/cc.2014.22005
6,554
Downloads
10,910
Views
Citations
A Relativistic Density Functional Study of the U
2
F
6
Molecule
(Articles)
Yunguang Zhang
Journal of Modern Physics
Vol.3 No.8
,August 16, 2012
DOI:
10.4236/jmp.2012.38113
3,535
Downloads
5,701
Views
Citations
Synthesis, Crystal Structure and Infrared Characterization of Bis(4-dimethylamino-pyridinium) Tetrachlorocuprate
(Articles)
Mahjouba Ben Nasr
,
Frédéric Lefebvre
,
Chérif Ben Nasr
American Journal of Analytical Chemistry
Vol.6 No.5
,April 13, 2015
DOI:
10.4236/ajac.2015.65044
4,691
Downloads
6,402
Views
Citations
Ab Initio and Density Functional Theory (DFT) Study on Clonazepam
(Articles)
Bachu Sylaja
,
Shanmugam Srinivasan
Open Journal of Biophysics
Vol.2 No.3
,July 27, 2012
DOI:
10.4236/ojbiphy.2012.23011
5,628
Downloads
11,758
Views
Citations
Effect of Molecular Weight and Molecular Distribution on Skin Structure and Shear Strength Distribution near the Surface of Thin-Wall Injection Molded Polypropylene
(Articles)
Keisuke Maeda
,
Koji Yamada
,
Kazushi Yamada
,
Masaya Kotaki
,
Hiroyuki Nishimura
Open Journal of Organic Polymer Materials
Vol.6 No.1
,January 7, 2016
DOI:
10.4236/ojopm.2016.61001
4,198
Downloads
5,454
Views
Citations
Dipole Moments of the Bioactive Constituents Present in Flutab Drug by
Ab-Initio
Calculations
(Articles)
Raghad Alajlani
,
Amal Alssadi
Open Journal of Physical Chemistry
Vol.9 No.4
,November 8, 2019
DOI:
10.4236/ojpc.2019.94013
856
Downloads
2,447
Views
Citations
Quantum-Chemical Description of Influence of the R-Groups on Formation of Peptide Bond
(Articles)
Jumber Kereselidze
,
Marine Kvaraia
,
George Mikuchadze
Computational Molecular Bioscience
Vol.4 No.2
,September 17, 2014
DOI:
10.4236/cmb.2014.42004
3,518
Downloads
4,446
Views
Citations
Spectroscopic Electrochemical Properties and DFT Calculation of 1-Aryltriazenes
(Articles)
Insa Seck
,
Mohamed Lamine Sall
,
Atoumane Ndiaye
,
Samba Fama Ndoye
,
Lalla Aïcha Ba
,
Matar Seck
International Journal of Organic Chemistry
Vol.13 No.4
,December 6, 2023
DOI:
10.4236/ijoc.2023.134009
60
Downloads
270
Views
Citations
Crystal Structure, Thermal Behaviour and Vibrational Spectra of Tetraethylammonium Dihydrogenmonophosphate Bis Phosphoric Acid
(Articles)
Ikram Dhouib
,
Salih Al-Juaid
,
Tahar Mhiri
,
Zakaria Elaoud
Crystal Structure Theory and Applications
Vol.2 No.1
,March 29, 2013
DOI:
10.4236/csta.2013.21002
2,918
Downloads
6,529
Views
Citations
Crystal Structure, Thermal Behavior and Vibrational Spectra of 4,4’Diamoniumdiphenylmethan Sulfate Hydrate
(Articles)
Takoua Ben Issa
,
Latifa Benhamada
Open Journal of Inorganic Chemistry
Vol.7 No.2
,April 30, 2017
DOI:
10.4236/ojic.2017.72004
1,606
Downloads
3,099
Views
Citations
Molecular Structure, Vibrational Analysis and First Order Hyperpolarizability of 4-Methyl-3-Nitrobenzoic Acid Using Density Functional Theory
(Articles)
Jyothi Prashanth
,
Gaddam Ramesh
,
Jarupula Laxman Naik
,
Jai Kishan Ojha
,
Byru Venkatram Reddy
,
Gandham Ramana Rao
Optics and Photonics Journal
Vol.5 No.3
,March 25, 2015
DOI:
10.4236/opj.2015.53008
5,197
Downloads
7,915
Views
Citations
This article belongs to the Special Issue on
Laser Spectroscopy and Sensing
On Cycle Related Graphs with Constant Metric Dimension
(Articles)
Murtaza Ali
,
Gohar Ali
,
Usman Ali
,
M. T. Rahim
Open Journal of Discrete Mathematics
Vol.2 No.1
,January 20, 2012
DOI:
10.4236/ojdm.2012.21005
5,971
Downloads
12,965
Views
Citations
DFT Calculations for Corrosion Inhibition of Ferrous Alloys by Pyrazolopyrimidine Derivatives
(Articles)
Nuha Ahmed Wazzan
,
Fatma Mohamed Mahgoub
Open Journal of Physical Chemistry
Vol.4 No.1
,January 29, 2014
DOI:
10.4236/ojpc.2014.41002
6,069
Downloads
10,927
Views
Citations
Spectroscopic Evaluation of the Molecular Structures of di-μ-Chlorobis(1,5-Cyclooctadiene) Iridium (I) and Rhodium (I) Complexes
(Articles)
Saheed A. Popoola
,
Abdulaziz A. Al-Saadi
Journal of Applied Mathematics and Physics
Vol.3 No.2
,January 30, 2015
DOI:
10.4236/jamp.2015.32021
3,754
Downloads
4,675
Views
Citations
Photochemical Reactions of Microcystin-LR Following Irradiation with UV Light
(Articles)
Yoshihiro Mizukami
Open Journal of Physical Chemistry
Vol.6 No.4
,October 25, 2016
DOI:
10.4236/ojpc.2016.64008
1,766
Downloads
2,977
Views
Citations
Site Selectivity of One Hydroxyl Group Bonded on the Surface of Finite (5, 0) Zigzag Carbon Nanotube
(Articles)
Afshin Abbasi
,
Hossein Mostaanzadeh
,
Reza Safari
,
Ebrahim Honarmand
Computational Chemistry
Vol.5 No.1
,December 6, 2016
DOI:
10.4236/cc.2017.51001
1,534
Downloads
2,624
Views
Citations
Molecular Docking and Conceptual DFT-Based Study of Some Potential SARS-CoV-2 Inhibitors
(Articles)
Norma Flores-Holguín
,
Daniel Glossman-Mitnik
Computational Molecular Bioscience
Vol.10 No.4
,December 31, 2020
DOI:
10.4236/cmb.2020.104008
542
Downloads
1,615
Views
Citations
<
1
2
3
...
>
Follow SCIRP
Contact us
+1 323-425-8868
customer@scirp.org
+86 18163351462(WhatsApp)
1655362766
Paper Publishing WeChat
Free SCIRP Newsletters
Home
Journals A-Z
Subject
Books
Sitemap
Contact Us
About SCIRP
Publication Fees
For Authors
Peer-Review Issues
Special Issues
News
Service
Manuscript Tracking System
Subscription
Translation & Proofreading
FAQ
Volume & Issue
Policies
Open Access
Publication Ethics
Preservation
Retraction
Privacy Policy
Copyright © 2006-2024 Scientific Research Publishing Inc. All Rights Reserved.
Top