Pub Date : 2023-06-20DOI: 10.1142/s2737416523500382
S. Mohammad‐Ali‐Nezhad, Samira Rezvani-Ardakani, R. Ghasemi
{"title":"Closed-loop deep brain stimulation using a type of fixed-time sliding mode controller for avoiding epileptiform discharge in a human cortical model","authors":"S. Mohammad‐Ali‐Nezhad, Samira Rezvani-Ardakani, R. Ghasemi","doi":"10.1142/s2737416523500382","DOIUrl":"https://doi.org/10.1142/s2737416523500382","url":null,"abstract":"","PeriodicalId":15603,"journal":{"name":"Journal of Computational Biophysics and Chemistry","volume":" ","pages":""},"PeriodicalIF":2.2,"publicationDate":"2023-06-20","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"44932735","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2023-06-16DOI: 10.1142/s2737416523500370
Muhammad Adnan, M. Faisal, Riaz Hussain, Muhammad Usman Khan, Junaid Yaqoob, Fakhar Hussain, S. A. Siddique, Umar Farooq, C. Cho, Jongchul Lim
{"title":"Modeling of Conjugated Core-Based Non-Fullerene Acceptor Materials for Organic Photovoltaic Applications","authors":"Muhammad Adnan, M. Faisal, Riaz Hussain, Muhammad Usman Khan, Junaid Yaqoob, Fakhar Hussain, S. A. Siddique, Umar Farooq, C. Cho, Jongchul Lim","doi":"10.1142/s2737416523500370","DOIUrl":"https://doi.org/10.1142/s2737416523500370","url":null,"abstract":"","PeriodicalId":15603,"journal":{"name":"Journal of Computational Biophysics and Chemistry","volume":" ","pages":""},"PeriodicalIF":2.2,"publicationDate":"2023-06-16","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"42352617","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2023-06-09DOI: 10.1142/s2737416523500369
D. Panda, B. L. Bhargava
{"title":"Molecular dynamics studies of mixtures of a deep eutectic solvent and cosolvents","authors":"D. Panda, B. L. Bhargava","doi":"10.1142/s2737416523500369","DOIUrl":"https://doi.org/10.1142/s2737416523500369","url":null,"abstract":"","PeriodicalId":15603,"journal":{"name":"Journal of Computational Biophysics and Chemistry","volume":" ","pages":""},"PeriodicalIF":2.2,"publicationDate":"2023-06-09","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"42901111","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2023-06-02DOI: 10.1142/s2737416523420036
A. R. Ayub, Umer Yaqoob, Sidra Rafiq, Salba Arshad, Muhammad Umar Dad, Haiyang Li
{"title":"A DFT study of bridge-driven engineering of non-fullerene based acceptors for efficacious organic solar cell applications","authors":"A. R. Ayub, Umer Yaqoob, Sidra Rafiq, Salba Arshad, Muhammad Umar Dad, Haiyang Li","doi":"10.1142/s2737416523420036","DOIUrl":"https://doi.org/10.1142/s2737416523420036","url":null,"abstract":"","PeriodicalId":15603,"journal":{"name":"Journal of Computational Biophysics and Chemistry","volume":" ","pages":""},"PeriodicalIF":2.2,"publicationDate":"2023-06-02","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"48464391","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2023-05-26DOI: 10.1142/s2737416523500357
R. Bhandare, N. Helina, A. Subramani, Ramalakshmi Natarajan, Suraj N. Mali, A. Shaik
{"title":"In Silico Studies, Design and Synthesis of Novel Fused Pyrimidine Derivatives as A DNA Gyrase Inhibitor and Antibacterial Activity Against Quinolone Resistant Escherichia Coli","authors":"R. Bhandare, N. Helina, A. Subramani, Ramalakshmi Natarajan, Suraj N. Mali, A. Shaik","doi":"10.1142/s2737416523500357","DOIUrl":"https://doi.org/10.1142/s2737416523500357","url":null,"abstract":"","PeriodicalId":15603,"journal":{"name":"Journal of Computational Biophysics and Chemistry","volume":" ","pages":""},"PeriodicalIF":2.2,"publicationDate":"2023-05-26","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"42275963","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2023-05-26DOI: 10.1142/s2737416523420024
A. R. Chaudhry, Yahia A. H. Obaidat, S. Muhammad, Saifedin Y. DaifAllah, B. Ul Haq
{"title":"Computational insight into electronic, optical and photophysical properties of small compounds for solar cell applications","authors":"A. R. Chaudhry, Yahia A. H. Obaidat, S. Muhammad, Saifedin Y. DaifAllah, B. Ul Haq","doi":"10.1142/s2737416523420024","DOIUrl":"https://doi.org/10.1142/s2737416523420024","url":null,"abstract":"","PeriodicalId":15603,"journal":{"name":"Journal of Computational Biophysics and Chemistry","volume":"1 1","pages":""},"PeriodicalIF":2.2,"publicationDate":"2023-05-26","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"63853746","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2023-05-22DOI: 10.1142/s2737416523500345
Mancong Zhang, Chengxu Zhu, Zeyu Luo, Junhao Liu, Muhammad Tahir Khan, Yawen Sun, Dongqing Wei, Yu-Juan Zhang
{"title":"Exploring key proteins, pathways and oxygen usage bias of proteins and metabolites in melanoma","authors":"Mancong Zhang, Chengxu Zhu, Zeyu Luo, Junhao Liu, Muhammad Tahir Khan, Yawen Sun, Dongqing Wei, Yu-Juan Zhang","doi":"10.1142/s2737416523500345","DOIUrl":"https://doi.org/10.1142/s2737416523500345","url":null,"abstract":"","PeriodicalId":15603,"journal":{"name":"Journal of Computational Biophysics and Chemistry","volume":" ","pages":""},"PeriodicalIF":2.2,"publicationDate":"2023-05-22","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"44490105","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2023-05-12DOI: 10.1142/s2737416523420012
Muhammad Adnan, Qandeel Fatima, Zobia Irshad, Riaz Hussain, Junaid Yaqoob, Muhammad Usman Khan, Nooruddin Ansari, S. A. Siddique, Jongchul Lim
{"title":"Role of Aromatic Heterocyclic Core-Based Materials as Donors for Organic and as Hole Transport Materials for Perovskites Solar cells","authors":"Muhammad Adnan, Qandeel Fatima, Zobia Irshad, Riaz Hussain, Junaid Yaqoob, Muhammad Usman Khan, Nooruddin Ansari, S. A. Siddique, Jongchul Lim","doi":"10.1142/s2737416523420012","DOIUrl":"https://doi.org/10.1142/s2737416523420012","url":null,"abstract":"","PeriodicalId":15603,"journal":{"name":"Journal of Computational Biophysics and Chemistry","volume":" ","pages":""},"PeriodicalIF":2.2,"publicationDate":"2023-05-12","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"43438357","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2023-05-05DOI: 10.1142/s2737416523500333
M. D. Olawale, F. Ola-Mudathir, E. Akintemi, J. Obaleye
{"title":"Anti-Tuberculous Drug Copper Pyrazinamide: Synthesis, Characterization, Theoretical DFT, Bioactivity and Toxicity Studies in the Liver","authors":"M. D. Olawale, F. Ola-Mudathir, E. Akintemi, J. Obaleye","doi":"10.1142/s2737416523500333","DOIUrl":"https://doi.org/10.1142/s2737416523500333","url":null,"abstract":"","PeriodicalId":15603,"journal":{"name":"Journal of Computational Biophysics and Chemistry","volume":" ","pages":""},"PeriodicalIF":2.2,"publicationDate":"2023-05-05","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"49387140","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2023-04-20DOI: 10.1142/s2737416523500321
M. Roney, A. M. Huq, Mohd Fadhlizil Fasihi Mohd Aluwi, S. N. Tajuddin
{"title":"In-silico Design of Curcumin Analogs as Potential Inhibitors of Dengue Virus NS2B/NS3 Protease","authors":"M. Roney, A. M. Huq, Mohd Fadhlizil Fasihi Mohd Aluwi, S. N. Tajuddin","doi":"10.1142/s2737416523500321","DOIUrl":"https://doi.org/10.1142/s2737416523500321","url":null,"abstract":"","PeriodicalId":15603,"journal":{"name":"Journal of Computational Biophysics and Chemistry","volume":" ","pages":""},"PeriodicalIF":2.2,"publicationDate":"2023-04-20","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"43931858","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
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