Search Result "Schrodinger maestro"
Screening of Potential Anticancer Compounds from Sargassum wightii to Target Breast Cancer Specific HER2 Receptor using in-silico Analysis
Journal: The Natural Products Journal
Volume: 6 Issue: 2 Year: 2016 Page: 108-115
Author(s): P. Balachandran,T. V. Ajay Kumar,V. Parthasarathy
Computer Aided Discovery of Potential Anti-inflammatory (S)-naproxen Analogs as COX-2 Inhibitors
Journal: Medicinal Chemistry
Volume: 9 Issue: 4 Year: 2013 Page: 553-559
Author(s): Nulgumnalli Manjunathaiah Raghavendra, Kota Ramakrishna, Vippula Sirisha, Pingli Divya, Alapati Venkateswara Rao
Atom-based 3D-QSAR and Docking Studies of Various 3-aminomethyl- 1,2-dihydro-4-phenyl-1-isoquinolones Derivatives as an Effective DPP-IV Inhibitors and its Validation
Journal: Immunology, Endocrine & Metabolic Agents in Medicinal Chemistry (Discontinued)
Volume: 13 Issue: 3 Year: 2013 Page: 221-231
Author(s): Ritesh Agrawal,Pratima Jain,Subodh Narayan Dikshit,Sourabh Jain,Radhe Shyam Bahare
Chemical Composition, In vitro and In silico Evaluation of Essential Oilfrom Ocimum tenuiflorum and Coriandrum sativum Linn for Lung Cancer
Journal: Current Computer-Aided Drug Design
Volume: 20 Issue: 5 Year: 2024 Page: 628-639
Author(s): Kumari Sunita Prajapati
Exploring Structural Requirements for a Class of Nucleoside Inhibitors (PfdUTPase) as Antimalarials: First Report on QSAR, Pharmacophore Mapping and Multiple Docking Studies
Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 16 Issue: 9 Year: 2013 Page: 739-757
Author(s): Probir Kumar Ojha, Kunal Roy
3D QSAR and Docking Studies of Various Amido and Benzyl-substituted 3-amino-4-(2-cyanopyrrolidide)pyrrolidinyl Analogs as DPP-IV Inhibitors
Journal: Protein & Peptide Letters
Volume: 20 Issue: 9 Year: 2013 Page: 1066-1078
Author(s): Ritesh Agrawal, Pratima Jain, Subodh Narayan Dikshit, Sourabh Jain
A Mechanistic Study of the Antibacterial Activity of Phytoconstituents ofPyracantha crenulata by Using Molecular Docking Studies
Journal: Current Chinese Chemistry
Volume: 2 Issue: 3 Year: 2022 Page: 20-39
Author(s): Ankit Kumar Singh
Structure-based Virtual Screening, Molecular Docking, MolecularDynamics Simulation, and Metabolic Reactivity Studies ofQuinazoline Derivatives for their Anti-EGFR Activity AgainstTumor Angiogenesis
Journal: Current Medicinal Chemistry
Volume: 31 Issue: 5 Year: 2024 Page: 595-619
Author(s): Altaf Ahmad Shah,Manoj Kumar Yadav,Mohammad Amjad Kamal
Molecular Docking Analysis of Adhatoda vasica with Thromboxane A2Receptor (TXA2R) (6IIU) and Antiviral Molecules for Possible DengueComplications
Journal: Infectious Disorders - Drug Targets
Volume: 23 Issue: 1 Year: 2023 Page: 6-16
Author(s): Vijayakumar Arumugam Ramamurthy,Meenalochini Prakash Gurunthalingam,Sree Sudha Tanguturi Yella
Current Insights and Molecular Docking Studies of the Drugs under Clinical Trialas RdRp Inhibitors in COVID-19 Treatment
Journal: Current Pharmaceutical Design
Volume: 28 Issue: 46 Year: 2022 Page: 3677-3705
Author(s): Mohammad A. Kamal