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Computational Chemistry
Submission
Computational Chemistry
ISSN Print:
2332-5968
ISSN Online:
2332-5984
www.scirp.net/journal/cc
E-mail:
[email protected]
Google-based Impact Factor:
0.82
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S
E
Ar Mechanism of the Products of 1,2-Dimethoxybenzene and a Captodative Olefin: A Theoretical Approach
()
René Santana-García
,
Judit Aviña-Verduzco
,
Rafael Herrera-Bucio
,
Pedro Navarro-Santos
Computational Chemistry
Vol.12 No.3
, October 9, 2024
DOI:
10.4236/cc.2024.123003
176
Downloads
1,142
Views
Citations
This article belongs to the Special Issue on
Prediction of the Photofading of Selected Derivatives of 5-(4-X-Phenylazo)-3-Cyano-1-(H or Ethyl)-6-Hydroxy-4-Methyl-2-Pyridone: Theoretical Studies, Comparison of AM1 and PM3 Methods
()
Krzysztof Wojciechowski
,
Lucjan Szuster
Computational Chemistry
Vol.12 No.2
, April 30, 2024
DOI:
10.4236/cc.2024.122002
196
Downloads
803
Views
Citations
This article belongs to the Special Issue on
Theoretical Investigation on the Stability and Reactivity of Imidazo [1,2-a] Pyridine
N
-
Acylhydrazone
Derivatives Using Density Functional Theory
()
Camara Tchambaga Etienne
,
Sangare Kassoum
,
Dosso Ouehi
,
Ablo Evrard
,
Sekou Diomande
,
Souleymane Coulibaly
,
Siomenan Coulibali
Computational Chemistry
Vol.12 No.1
, January 31, 2024
DOI:
10.4236/cc.2024.121001
265
Downloads
1,038
Views
Citations
This article belongs to the Special Issue on
DFT-Based Chemical Reactivity Descriptors, Pharmacokinetics and Molecular Docking Studies of Thymidine Derivatives
()
Mohammad Ahad Hossain
,
Shahin Sultana
,
Mohammad Mazherul Islam
,
Sonia Akhter
,
Faria Nur
,
Fatima Majabin
,
Kantom Islam
,
Kazi Jawad Hossain
,
Yasuhiro Ozeki
,
Sarkar M. A. Kawsar
Computational Chemistry
Vol.11 No.4
, October 31, 2023
DOI:
10.4236/cc.2023.114006
426
Downloads
2,096
Views
Citations
This article belongs to the Special Issue on
Design of New Thiadiazole Derivatives with Improved Antidiabetic Activity
()
Chiépi Nadège Dominique Dou
,
Georges Stéphane Dembele
,
Mamadou Guy-Richard Kone
,
Nanou Tiéba Tuo
,
Fandia Konate
,
Adama Niare
,
Panaghiotis Karamanis
,
Nahossé Ziao
Computational Chemistry
Vol.11 No.3
, July 26, 2023
DOI:
10.4236/cc.2023.113005
350
Downloads
1,426
Views
Citations
This article belongs to the Special Issue on
Functionality of Covalent Organic Framework (COF) in Gas Storage Application: First Principal Study
()
Mashael Alharbi
,
Raghad Aljohani
,
Raghad Alzahrani
,
Yara Alsufyani
,
Nuha Alsmani
Computational Chemistry
Vol.11 No.3
, May 31, 2023
DOI:
10.4236/cc.2023.113004
519
Downloads
2,491
Views
Citations
This article belongs to the Special Issue on
A TD-DFT Study for the Excited State Calculations of Microhydration of N-Acetyl-Phenylalaninylamide (NAPA)
()
Md. Alauddin
,
Joya Datta Ripa
Computational Chemistry
Vol.11 No.2
, April 28, 2023
DOI:
10.4236/cc.2023.112003
424
Downloads
1,728
Views
Citations
This article belongs to the Special Issue on
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