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Molecular Docking

https://www.profacgen.com/molecular-docking.htm<br>The interactions between proteins and other molecules play important roles in various biological processes, including gene transcription and expression, metabolic regulation, signal transduction, and cell communication. Knowing structural aspects of a protein complexed with its binding partner can help understand the mechanism of such interaction and thus is important for drug discovery and development. However, it remains difficult and expensive to obtain complex structures by experimental methods, such as X-ray crystallography or NMR. Thus, computational docking is considered an important approach to predicting the three-dimensional structures of these interacting partners.

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Molecular Docking

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  1. 2020/10/8 Molecular Docking - Profacgen  (https://www.profacgen.com) Home (/) Services Products APP & TECH Contact Us About Us (https://www.profacgen.com/contact- (https://www.profacgen.com/about- us.htm) us.htm) Molecular Docking Home (http://www.profacgen.com) / Services / Bioinformatics Platform Introduction  Sign In (https://www.profacgen.com/SignIn.aspx) / Register (https://www.profacgen.com/Bioinformatics-Platform-Introduction.htm) / Virtual Screening (https://www.profacgen.com/computer-aided-drug- (https://www.profacgen.com/SignUp.aspx) design.htm) / Molecular Docking https://www.profacgen.com/molecular-docking.htm 1/5

  2. 2020/10/8 Molecular Docking - Profacgen Molecular Docking The interactions between proteins and other molecules play important roles in various biological processes, including gene transcription and expression, metabolic regulation, signal transduction, and cell communication. Knowing structural aspects of a protein complexed with its binding partner can help understand the mechanism of such interaction and thus is important for drug discovery and development. However, it remains difficult and expensive to obtain complex structures by experimental methods, such as X-ray crystallography or NMR. Thus, computational docking is considered an important approach to predicting the three-dimensional structures of these interacting partners. https://www.profacgen.com/molecular-docking.htm 2/5

  3. 2020/10/8 Molecular Docking - Profacgen Profacgen employs computational docking techniques for a variety of purposes. Single docking experiments are useful for exploring protein functions, studying enzyme inhibitors and substrates, and elucidating biochemical pathways. Virtual screening of large databases of available chemicals can be applied for lead detection and optimization. The docking procedure also works seamlessly with upstream and downstream computational modeling protocols, which offers unparalleled opportunities for structure-based drug discovery. Please see below the types of computational docking protocols we can perform for you: Protein-Ligand Docking (/protein–ligand-docking.htm) Protein-Protein Docking (/protein–protein-docking.htm) Protein-Nucleic Acid Docking (/protein%E2%80%93nucleic-acid-docking.htm) Antibody-Antigen Docking (/antibody%E2%80%93antigen-docking.htm) Protein-Peptide Docking (/protein–peptide-docking.htm) Protein–Carbohydrate Docking (/protein–carbohydrate-docking.htm) Protein–Lipid Docking (/protein–lipid-docking.htm) Please feel free to contact us with your molecular docking projects. Profacgen is here to offer you professional and thoughtful service. SERVICES  Protein Production (https://www.profacgen.com/protein-production.htm)  https://www.profacgen.com/molecular-docking.htm 3/5

  4. 2020/10/8 Molecular Docking - Profacgen  Bioinformatics Platform Introduction  (https://www.profacgen.com/Bioinformatics-Platform-Introduction.htm) In Silico Protein-protein Interactions Prediction (https://www.profacgen.com/s… * Bioinformatics Data Management (https://www.profacgen.com/Bioinformatic… * Biological Data Analysis (https://www.profacgen.com/Biological-Data-Analysi… * Computational Protein Analysis (https://www.profacgen.com/Computational-…  * Custom Bioinformatics Software Development (https://www.profacgen.com/… * Virtual Screening (https://www.profacgen.com/computer-aided-drug-design.…  * 3D-QSAR (https://www.profacgen.com/3D-QSAR.htm) * ADME/Tox Prediction (https://www.profacgen.com/adme-tox-prediction.htm) * Hybrid methods (https://www.profacgen.com/services/Hybrid-methods) * Ligand-based virtual screening (LBVS) (https://www.profacgen.com/services/lig… * Molecular Docking (https://www.profacgen.com/molecular-docking.htm)  * Antibody–Antigen Docking (https://www.profacgen.com/antibody-antigen-docking.h… Protein–Carbohydrate Docking (https://www.profacgen.com/protein-carbohydrate-… Protein–Ligand Docking (https://www.profacgen.com/protein-ligand-docking.htm) Protein–Lipid Docking (https://www.profacgen.com/protein-lipid-docking.htm) Protein–Nucleic Acid Docking (https://www.profacgen.com/Protein-Nucleic-Acid-Doc… Protein–Peptide Docking (https://www.profacgen.com/protein-peptide-docking.htm) Protein–Protein Docking (https://www.profacgen.com/protein-protein-docking.htm) Quantum Mechanics/Chemistry in Drug Design (https://www.profacgen.com/Qu… * Structure-based virtual screening (SBVS) (https://www.profacgen.com/services/s… *  Protein Analysis (https://www.profacgen.com/protein-analysis.htm)   Drug Development (https://www.profacgen.com/drug-development.htm)  INQUIRY (https://www.profacgen.com/order.htm? i1=Molecular+Docking) CONTACT US https://www.profacgen.com/molecular-docking.htm 4/5

  5. 2020/10/8 Molecular Docking - Profacgen  Email: info@profacgen.com  Tel: 1-631-448-8149  Fax: 1-631-938-8127  45-1 Ramsey Road, Shirley, NY 11967, USA Copyright ©2010 - 2020 Profacgen. All rights reserved. | Terms and Conditions (https://www.profacgen.com/term-and- conditions.htm) | Privacy Policy (https://www.profacgen.com/privacy-policy.htm) https://www.profacgen.com/molecular-docking.htm 5/5

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