3 Day
International Virtual Workshop
Molecular Dynamics Simulations: From Theory
to Practice
24-26 Jan 2026
Quaxon Bio & IT Solutions, is going to conduct it’s 69th international
virtual workshop on “Molecular Dynamics Simulation: From
Theory to Practice ” scheduled to held from 24 to 26
January 2026 globally at Indian Standard Time 7.00 PM
Last Date to Register 22. 01.2026 or as per the seat
availability.
Objective
The workshop will introduce the field of Molecular
Dynamics Simulation to the participants through lecture, demonstration
and one to one hands-on session. The objective of the workshop is to
familiarize the participants with theoretical as well as practical concept of
molecular dynamics simulation so that they can apply this technique in their
study and research.
The expected outcome is that the participants should be
able to conduct MD simulations using Gromacs for Protein-Ligand complex and
able to analyze the output.
Continue reading or visit website post
https://qbiits.org/molecular-dynamics-simulation-gromacs-for-bioscience/
World Wide Time Schedule
India,
Srilanka:7.00 PM
Nepal:7.15 PM
Central
European Time: 2.30 PM
Washington DC:8.00
AM, Canada:
9:30 AM Moscow: 4.00 PM,
South Africa: 3:30
PM, Dubai:
5.00 PM, Moroco:
2.30 PM ,
Bangkok: 8.30 PM,
London:
1:30 PM Kuwait:
5.00 PM
Kindly Visit https://savvytime.com/ to know the starting time in your country’s time zone
Platform : Virtual mode(Google Meet)
Eligibility:
All
Bioscience/Botany/pharmacy/biotech/biochemistry/biophysics/Bioinformatics students,
faculties and research scholar are eligible for this event.(No prior coding experience
is required, must have basic computer skill on windows)
System Requirement
Must have Windows 10 or above with minimum 4 GB(WSL
option) RAM/Ubuntu/other Linux variants. No coding knowledge required
About the Theme
Molecular Dynamics (MD) simulation is a
computational technique used in molecular modelling to study the dynamic behaviour
of atoms and molecules over time. It provides valuable insights into the behaviour
and properties of complex systems at the atomic level. Molecular simulations
usually deployed to calculate or predict properties and quantities that may be
difficult to observe experimentally. This thechnology is
widely used in various scientific fields, such as chemistry,
bioscience, materials science, and physics, to investigate molecular
structures, conformational changes, thermodynamics, and kinetics of chemical
reactions and other properties.
GROMACS is one of
the most important and widely used molecular dynamics simulation software
packages in computational bioscience because of its high performance, accuracy,
and user-friendly workflow. It enables researchers to study the dynamic
behavior, stability, and interactions of biomolecules such as proteins, nucleic
acids, and protein–ligand complexes at the atomic level. GROMACS plays a
crucial role in drug discovery, protein structure–function analysis, enzyme
mechanism studies, and vaccine design by allowing realistic simulation of
biological systems under physiological conditions. Its efficient algorithms,
support for multiple force fields, and powerful analysis tools make it
especially valuable for bioscience students, research scholars, and faculty for
both learning and advanced research applications.
Read more about the application of Molecular Dynamics Simulation
Application of MD Simulation in Bioscience
Application of MD Simulation in nano science and Biophysics
This method has a central importance in bioscience and pharmaceutical science and it became an indispensable tools in bioscience research. Some applications are
· Design and discovery of new drug molecules.
· Understanding the dynamics of protein folding process.
· Characterizing biomolecular interactions:
· Understanding molecular cause of disease and drug resistance in microbes
Tools to be used: GROMACS, VMD and other open source tools
No mandatory requirement of Linux OS, but must have windows 10 or above
Detail Syllabus and schedule
*The schedule of the programme may change in case of any
unseen problem.
24/01/2026
Theory Session
Hands-on-session
Installation overview and
environment setup for GROMACS, Selection of a protein–ligand complex (from PDB),
Cleaning and preprocessing protein structure,
Ligand preparation overview, Generating topology files, Defining simulation box Solvation and ion addition
25/01/2026
26/01/2026
Hands-on-Session
Best practices and case studies
Key Takeaway
·
Complete practical based
training and hands-on-session of 6 plus hours
·
Designed for beginner to
advance level learners
·
No prior coding experience
required
·
Applicable for Both Linux and
Windows user
·
E-Certificate for all
participants
·
Session recording and video
tutorial for further practice
Payment and Registration
Step-1: Pay the fee using the
below link as per your category
Step-2: Fill-up the
registration form after payment, attach the screenshot of payment
PAYMENT
For Indian participants
For faculty/pdf/RA and other working professionals Rs.1100/-
For students and PhD Scholar Rs.1000/-
Payment link for Indians
https://pages.razorpay.com/pl_NMC6iJUcHHr686/view
or for Alternative
payment kindly contact +91-9692521875
For international participants(other than India)
For students/PhD Scholar $20/-
For faculty/pdf and other working professionals $25/-
Payment link
https://www.paypal.com/paypalme/Workshop334
Registration
Must Register After the Payment Using Below Link
https://docs.google.com/forms/d/1LCTA_5LdA3sCTDjPUD9Ann_tc8CH44hP1o73G2Yz5t8/edit
About Us : Quaxon Bio & IT
Solutions is a fastest growing EduTech start-up registered to Ministry
of Micro, Small and Medium Enterprises, Govt. of India. We are acting
as industry-academic interface by knowledge transformation and produce human
resource equipped with next generation technology. We are conducting webinar,
conference and workshop on with international participants across the globe for
knowledge transformation. Our main objective is to provide cutting edge
technical education at affordable price to everyone. This is going to be our
69th International virtual Workshop
Click to connect or call us +91-9692521875
Write to us quaxonbiits@gmail.com
For details term and condition kindly visit webpost
https://qbiits.org/molecular-dynamics-simulation-gromacs-for-bioscience/
Quaxon Bio & IT Solutions, India www.qbiits.org
Email: quaxonbiits@gmail.com
WhatsApp: +919692521875
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