Search Result "CHARMM"
Biomolecular Simulations of Metalloenzymes: Strategies to Tackle the Missing Parameter Problem
Journal: Current Inorganic Chemistry (Discontinued)
Volume: 2 Issue: 3 Year: 2012 Page: 254-262
Author(s): Alexandra T.P. Carvalho
Structure Prediction of Neuroendocrine Convertase -2: A Potential Target in Various Cancers
Journal: Protein & Peptide Letters
Volume: 16 Issue: 4 Year: 2009 Page: 383-391
Author(s): Polamarasetty Aparoy, Munmun Chatterjee, Lalitha Guruprasad, Pallu Reddanna
A Perspective into âTELâ-Tenofovir, Emtricitabine and LamivudineAntileprotic Activities by Drug Repurposing and Exploringthe Possibility of Combination Chemotherapy with Drug RescuedMolecules for a Leprosy Free Mankind
Journal: Recent Advances in Anti-Infective Drug Discovery
Volume: 18 Issue: 3 Year: 2023 Page: 170-177
Author(s): Sree Sudha Tanguturi Yella,Vijayakumar Arumugam Ramamurthy,Thameemul Ansari Lappathai Habeeb Mohamed
Bioactive Isolates of Morus Species as Antibacterial Agents and their In Silico Profiling
Journal: Letters in Drug Design & Discovery
Volume: 18 Issue: 5 Year: 2021 Page: 445-453
Author(s): Aditya Shimoga Janakirama Rao,Venugopal Thegur Mudduraj Urs,Jayanna Nayakarahatty Devanna,Paramesha Mahadevappa,Ramesh Chapeyil Kumaran
Protein Interactions, Hydration and Solvation Structure in Osmolyte Solutions: Lysozyme in Free Amino Acids Solutions
Journal: Current Physical Chemistry
Volume: 4 Issue: 2 Year: 2014 Page: 202-215
Author(s): Abdoul Rahim,K. J. Jalkanen
Study of Interactions of Nucleoside Anticancer Drugs, Capecitabine andGemcitabine, with SWNT and BNNT using Molecular and QuantumMechanical Calculations
Journal: Letters in Organic Chemistry
Volume: 21 Issue: 3 Year: 2024 Page: 238-254
Author(s):
Detection of Melanogenesis and Anti-Apoptosis-Associated MelanomaFactors: Array CGH and PPI Mapping Integrating Study
Journal: Protein & Peptide Letters
Volume: 28 Issue: 12 Year: 2021 Page: 1408-1424
Author(s): Shang-Jun Yin,Guo-Ying Qian,Jun-Mo Yang,Jinhyuk Lee,Yong-Doo Park
COX-2 Docking Structural Analysis with Phytochemical Extracts of Rosemary: A Possible Cytotoxicity on Head and Neck Squamous Cell Carcinoma Cell Line (HEp-2)
Journal: Anti-Cancer Agents in Medicinal Chemistry
Volume: 19 Issue: 1 Year: 2019 Page: 1473-1480
Author(s): Ihab S. Abd El-Hamid,Yara Y. Mouselhy,Marwa M. El-Shafei,Marwa M. Sayed,Aly F. Mohamed,Doaa B. Farag
A Perspective on Quantum Mechanics Calculations in ADMET Predictions
Journal: Current Topics in Medicinal Chemistry
Volume: 13 Issue: 11 Year: 2013 Page: 1257-1272
Author(s): J. Phillip Bowen,Osman F. Guner
Applications of in Silico Methods for Design and Development of Drugs Targeting Protein-Protein Interactions
Journal: Current Topics in Medicinal Chemistry
Volume: 19 Issue: 7 Year: 2019 Page: 534-554
Author(s): Vittoria Cicaloni,Alfonso Trezza,Francesco Pettini,Ottavia Spiga