Pub Date : 2023-12-15DOI: 10.1142/s2737416523500680
Ernest Oduro-Kwateng, Ali H. Rabbad, M. E. Soliman
{"title":"The Juxtaposition of Allosteric and Catalytic Inhibition in PLK1: Tradeoff for Chemotherapy and Thermodynamic Profiles of KBJK557 and BI 6727","authors":"Ernest Oduro-Kwateng, Ali H. Rabbad, M. E. Soliman","doi":"10.1142/s2737416523500680","DOIUrl":"https://doi.org/10.1142/s2737416523500680","url":null,"abstract":"","PeriodicalId":15603,"journal":{"name":"Journal of Computational Biophysics and Chemistry","volume":"65 1","pages":""},"PeriodicalIF":2.2,"publicationDate":"2023-12-15","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"138999027","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 : 2023-12-15DOI: 10.1142/s2737416523500692
S. Anitha, S. Nandhini, D. Premnath, M. Indiraleka
{"title":"Computational approach to identify the Key Genes for Invasive Lobular Carcinoma (ILC) Diagnosis and Therapies","authors":"S. Anitha, S. Nandhini, D. Premnath, M. Indiraleka","doi":"10.1142/s2737416523500692","DOIUrl":"https://doi.org/10.1142/s2737416523500692","url":null,"abstract":"","PeriodicalId":15603,"journal":{"name":"Journal of Computational Biophysics and Chemistry","volume":"87 4","pages":""},"PeriodicalIF":2.2,"publicationDate":"2023-12-15","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"138998183","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}
{"title":"Molecular Dynamics Study on the Binding Characteristics and Transport Mechanism of Polysaccharides with Different Molecular Weights in Camellia Oleifera Abel","authors":"Jihang Zhai, Fangfang Fan, Chaojie Wang, Zhiyang Zhang, Sheng Zhang, Yuan Zhao","doi":"10.1142/s2737416523500679","DOIUrl":"https://doi.org/10.1142/s2737416523500679","url":null,"abstract":"","PeriodicalId":15603,"journal":{"name":"Journal of Computational Biophysics and Chemistry","volume":"87 5","pages":""},"PeriodicalIF":2.2,"publicationDate":"2023-12-08","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"139010924","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}
{"title":"Fragment-Based Protein Structure Prediction, Where Are We Now?","authors":"Qudsia Noor, Raheem Kayode, Rizwan Riaz, Areeba Siddiqui, Aiza Hassan Mirza, Abdul Rauf Siddiqi","doi":"10.1142/s2737416523300018","DOIUrl":"https://doi.org/10.1142/s2737416523300018","url":null,"abstract":"","PeriodicalId":15603,"journal":{"name":"Journal of Computational Biophysics and Chemistry","volume":"73 2","pages":""},"PeriodicalIF":2.2,"publicationDate":"2023-12-08","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"139011319","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 : 2023-12-01DOI: 10.1142/s2737416523500667
Neha Maurya, Mareechika Gaddam, Abha Sharma
{"title":"Computational studies of multi-target directed ligands against acetylcholinesterase, butyrylcholinesterase and amyloid beta as potential anti-Alzheimer's agents","authors":"Neha Maurya, Mareechika Gaddam, Abha Sharma","doi":"10.1142/s2737416523500667","DOIUrl":"https://doi.org/10.1142/s2737416523500667","url":null,"abstract":"","PeriodicalId":15603,"journal":{"name":"Journal of Computational Biophysics and Chemistry","volume":" 2","pages":""},"PeriodicalIF":2.2,"publicationDate":"2023-12-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"138613336","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 : 2023-12-01DOI: 10.1142/s2737416523500655
A. Chopade, Vikram H. Potdar, Suraj N. Mali, Susmita Yadav, Anima Pandey, Chin-Hung Lai, Essa M. Saied, Oberdan Oliveira Ferreira, M. D. de Oliveira, S. S. Gurav, Eloísa Helena de Aguiar Andrade
{"title":"Antifibromyalgic activity of Phytomolecule Niranthin: In-Vivo analysis, Molecular docking, Dynamics and DFT","authors":"A. Chopade, Vikram H. Potdar, Suraj N. Mali, Susmita Yadav, Anima Pandey, Chin-Hung Lai, Essa M. Saied, Oberdan Oliveira Ferreira, M. D. de Oliveira, S. S. Gurav, Eloísa Helena de Aguiar Andrade","doi":"10.1142/s2737416523500655","DOIUrl":"https://doi.org/10.1142/s2737416523500655","url":null,"abstract":"","PeriodicalId":15603,"journal":{"name":"Journal of Computational Biophysics and Chemistry","volume":"6 11","pages":""},"PeriodicalIF":2.2,"publicationDate":"2023-12-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"138609620","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 : 2023-11-17DOI: 10.1142/s2737416523500643
M. Naveed, Hamza Jamil, Tariq Aziz, Syeda Izma Makhdoom, A. Alamri, M. Alhomrani, Roaa Mohammed Tahir Kassim, Nehad A. Shaer, Aminah A. Barqawi, N. Al-Abbas
{"title":"Spatially Resolved Transcriptomics Reveals Local Invasion-Related Genes in Liver Hepatocellular Carcinoma: Exploring the Therapeutic Potential of a Chimeric Protein Targeting Glypican-3","authors":"M. Naveed, Hamza Jamil, Tariq Aziz, Syeda Izma Makhdoom, A. Alamri, M. Alhomrani, Roaa Mohammed Tahir Kassim, Nehad A. Shaer, Aminah A. Barqawi, N. Al-Abbas","doi":"10.1142/s2737416523500643","DOIUrl":"https://doi.org/10.1142/s2737416523500643","url":null,"abstract":"","PeriodicalId":15603,"journal":{"name":"Journal of Computational Biophysics and Chemistry","volume":"45 9","pages":""},"PeriodicalIF":2.2,"publicationDate":"2023-11-17","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"139264690","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 : 2023-11-07DOI: 10.1142/s2737416523500631
Muhammad Naveed, Imran Ali, Tariq Aziz, Nouman Ali, Ali Hassan, Shafiq Ur Rahman, Riffat Aziz, Metab Alharbi, Abdulrahman Alsahammari, Abdullah F. Alasmari
{"title":"Assessment of <i>Melia azedarach</i> Plant Extracts Activity against Hypothetical Protein of Mycobacterium Tuberculosis via GC-MS Analysis and <i>In-Silico</i> approaches","authors":"Muhammad Naveed, Imran Ali, Tariq Aziz, Nouman Ali, Ali Hassan, Shafiq Ur Rahman, Riffat Aziz, Metab Alharbi, Abdulrahman Alsahammari, Abdullah F. Alasmari","doi":"10.1142/s2737416523500631","DOIUrl":"https://doi.org/10.1142/s2737416523500631","url":null,"abstract":"","PeriodicalId":15603,"journal":{"name":"Journal of Computational Biophysics and Chemistry","volume":"112 10","pages":"0"},"PeriodicalIF":0.0,"publicationDate":"2023-11-07","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"135541073","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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