Volume 21, Issue 2
Accelerating Rheumatoid Arthritis Drug Repurposing: A Computational Approach
Pp: 125-128
Author(s): Muskan Gupta, Tuhin Mukherjee and Satyajit Mohanty*
DOI: 10.2174/0115734099326517240801035901
Integrated Bioinformatics Analysis and Target Drug Prediction of Inflammatory Bowel Disease Co-existent Diabetes Mellitus
Pp: 129-141
Author(s): Lili Yang, Ning Wang, Yutong Wang, Wen Li, Ziyang Kong, Bin Zhang* and Yaoyao Bian*
DOI: 10.2174/0115734099282247231211111219
Identification of Potential Inhibitors of Three NDM Variants of Klebsiella Species from Natural Compounds: A Molecular Docking, Molecular Dynamics Simulation, and MM-PBSA Study
Pp: 142-165
Author(s): Nakul Neog, Minakshi Puzari and Pankaj Chetia*
DOI: 10.2174/0115734099294294240311061115
Exploring the Molecular Mechanism by which Kaempferol Attenuates Sepsis-related Acute Respiratory Distress Syndrome Based on Network Pharmacology and Experimental Verification
Pp: 166-178
Author(s): Weichao Ding, Changbao Huang, Juan Chen, Wei Zhang, Mengmeng Wang, Xiaohang Ji, Shinan Nie* and Zhaorui Sun*
DOI: 10.2174/0115734099295805240126043059
3D-QSAR, Pharmacophore Modeling, ADMET, and DFT Studies of Halogenated Conjugated Dienones as Potent MAO-B Inhibitors
Pp: 179-193
Author(s): Githa Elizabeth Mathew, Chonny Herrera-Acevedo, Marcus Tullius Scotti, Sunil Kumar, Avni Berisha, Savaş Kaya, Saleh Alfarraj, Mohammad Javed Ansari, Archana Dhyani, Sachithra Thazhathuveedu Sudevan, Mohan Kumar and Bijo Mathew*
DOI: 10.2174/0115734099307062240801053329
Network Pharmacology, Molecular Docking and in vivo-based Analysis on the Effects of the MBZM-N-IBT for Arthritis
Pp: 194-210
Author(s): Alok Kumar Moharana, Mahendra Gaur, Tapas Kumar Mohapatra, Rudra Narayan Dash and Bharat Bhusan Subudhi*
DOI: 10.2174/0115734099307360240731052835
Design, Synthesis, Biological and in silico Evaluation of Novel Indazole-pyridine Hybrids for the Treatment of Breast Cancer
Pp: 211-225
Author(s): Ishan Panchal*, Rati Kailash Prasad Tripathi, Mange Ram Yadav, Meet Valera and Kinjal Parmar
DOI: 10.2174/0115734099308839240724100224
Computational Exploration of Isatin Derivatives for InhA Inhibition in Tuberculosis: Molecular Docking, MD Simulations and ADMET Insights
Pp: 226-254
Author(s): Vaishali Pavalbhai Patel, Rati Kailash Prasad Tripathi* and Abhay Dharamsi
DOI: 10.2174/0115734099333313240909103833
