Publication date: October 2023
Source: Computational Biology and Chemistry, Volume 106
Author(s): Tushar Ranjan Sahoo, Sabyasachi Patra, Swati Vipsita
Monthly Archives: October 2023
Interpretable single-cell transcription factor prediction based on deep learning with attention mechanism
Publication date: October 2023
Source: Computational Biology and Chemistry, Volume 106
Author(s): Meiqin Gong, Yuchen He, Maocheng Wang, Yongqing Zhang, Chunli Ding
The prevalence of dementia in humans could be the result of a functional adaptation
Publication date: October 2023
Source: Computational Biology and Chemistry, Volume 106
Author(s): Alan G. Holt, Adrian M. Davies
Theoretical investigation of hydroxylated analogues of valinomycin as potassium transporter
Publication date: October 2023
Source: Computational Biology and Chemistry, Volume 106
Author(s): Lucia Sessa, Simona Concilio, Francesco Marrafino, Arkadeep Sarkar, Rosita Diana, Stefano Piotto
Chemico-biological interaction unraveled the potential mechanistic pathway of <em>Ixeridium dentatum</em> compounds against atopic dermatitis
Publication date: October 2023
Source: Computational Biology and Chemistry, Volume 106
Author(s): Juri Jin, Md. Helal Uddin Chowdhury, Tuhin Das, Sourav Biswas, Ke Wang, Md. Hafizur Rahman, Ki Young Choi, Md. Adnan
An efficient new method of ytterbium(III) triflate catalysis approach to the synthesis of substituted pyrroles: DFT, ADMET, and molecular docking investigations
Publication date: October 2023
Source: Computational Biology and Chemistry, Volume 106
Author(s): Goncagül Serdaroğlu, Nesimi Uludag, Elvan Üstün
Synthesis, biological evaluation, and molecular modelling of novel quinoxaline-isoxazole hybrid as anti-hyperglycemic
Publication date: October 2023
Source: Computational Biology and Chemistry, Volume 106
Author(s): Lacksany Phongphane, Siti Nurshahira Mohd Radzuan, Mohamad Hafizi Abu Bakar, Mohammad Tasyriq Che Omar, Unang Supratman, Desi Harneti, Habibah A. Wahab, Mohamad Nurul Azmi
Exploring the impact of <em>CYP11A1</em>’s missense SNPs on the interaction between CYP11A1 and cholesterol: A comprehensive structural analysis and MD simulation study
Publication date: October 2023
Source: Computational Biology and Chemistry, Volume 106
Author(s): Salaheddine Redouane, Houda Harmak, Zouhair Elkarhat, Hicham Charoute, Abderrahim Malki, Abdelhamid Barakat, Hassan Rouba
Quantum mechanical approaches and molecular docking studies of metal based anticancer drugs cis-Diammine glycolato platinum and Diaminocyclohexane oxalatoplatinum structures
Publication date: October 2023
Source: Computational Biology and Chemistry, Volume 106
Author(s): Madhavi Sahadevan, Mullainathan Sundaram, Karunagaran Subramanian
Polyphenolic flavonoid compounds act as the inhibitory potential of aggregation process: Implications for the prevention and therapeutics against FALS-associated D101G SOD1 mutant
Publication date: Available online 6 October 2023
Source: Computational Biology and Chemistry
Author(s): Hussein maitham Qassim, Bagher Seyedalipour, Payam Baziyar, Salman Ahamady-Asbchin