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Strain In silico screening

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In silico screening is revolutionizing synthetic biology by offering a powerful and cost-effective approach to biological research and drug discovery. Our comprehensive services, coupled with cutting-edge technology and expert guidance, position us at the forefront of this transformative field. Unlock the full potential of your research with our In Silico Screening Services.

Introduction to In-Silico Screening Technology

In silico screening constitutes a groundbreaking approach within the realm of synthetic biology. This cutting-edge methodology leverages computational algorithms to expedite the exploration and advancement of fresh biological molecules and pathways, instigating a fundamental shift in the manner in which we engineer biological systems.

In silico screening of peptide from edible peptide database. Fig 1. In silico screening of peptide from edible peptide database. (Imai K, et al., 2021)

Mechanism of In-Silico Screening Technology

  • Molecular Docking. In silico screening employs molecular docking simulations to predict the binding affinity between small molecules and biological targets, facilitating the identification of potential drug candidates or enzyme-substrate interactions.
  • Virtual Screening. Through virtual screening, vast libraries of compounds are computationally screened to pinpoint molecules with the desired biological activity, offering a cost-effective and time-efficient alternative to traditional high-throughput screening.
  • QSAR Modeling. Quantitative structure-activity relationship (QSAR) modeling quantifies the relationship between the chemical structure of compounds and their biological activity, enabling the prediction of compound properties with remarkable accuracy.
  • Molecular Dynamics Simulations. In silico screening leverages molecular dynamics simulations to simulate the dynamic behavior of biomolecules, providing insights into their structural stability and function.

Service Offering

  • Target Identification. Our services encompass target identification, assisting researchers in selecting suitable biological targets for their projects.
  • Library Screening. We offer comprehensive library screening services, allowing clients to evaluate a vast array of chemical compounds for specific biological activities.
  • Structure-Based Design. Our experts employ structure-based design to rationally engineer molecules with enhanced properties, such as increased binding affinity or enzymatic activity.
  • ADME Prediction. We provide Absorption, Distribution, Metabolism, and Excretion (ADME) predictions to assess the pharmacokinetic properties of potential drug candidates.
  • Toxicity Assessment. Our toxicity assessment services aid in the early identification of compounds with potential safety concerns, streamlining the drug discovery process.

Process of Our In-Silico Screening Services

Process of Our In-Silico Screening Services.


We initiate each project with a thorough consultation to understand the client's objectives and requirements.

Computational Analysis

Our experts employ a range of computational techniques, including molecular docking, virtual screening, QSAR modeling, and molecular dynamics simulations.

Report Delivery

Clients receive detailed reports summarizing the findings and actionable recommendations for further research.

Data Collection

We gather relevant biological and chemical data, including target structures, compound libraries, and experimental data.

Results Interpretation

We analyze and interpret the computational results, providing valuable insights and recommendations.

Our Technologies

  • Computational Chemistry Tools
  • Molecular Modeling Software
  • Molecular Docking Software
  • Cheminformatics Databases
  • QSAR Modeling Software
  • High-Performance Computing Clusters
  • Molecular Dynamics Simulation Software
  • Bioinformatics Tools

CD Biosynsis specializes in providing exceptional services in the field of synthetic biology. By choosing our service platform, you have access to our expertise, advanced technologies, and personalized support to take your research to new heights. Contact us to know more details about our services.


  1. Imai, K.; et al. In Silico Screening of a Bile Acid Micelle Disruption Peptide for Oral Consumptions from Edible Peptide Database. Foods. 2021, 10(10):2496.

Please note that all services are for research use only. Not intended for any clinical use.

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