Hit Discovery Course Bundle_Hero

Hit discovery course bundle

Includes access to all paid, intermediate life science courses, including: designing quality ligand libraries, target enablement, validation, and preparation, and virtual screening with integrated physics and machine learning

Details
Modules
10+
Duration
3 months from selected start date
Level
Intermediate
Cost
$1435 for non-student users
$500 for student / post-doc
Who should take this course?
Medicinal chemists, cheminformaticians, ML scientists, new computational chemists

Overview

As structural data and ligand libraries continue to grow, so does the demand for validated, scalable, and computationally efficient hit discovery workflows. 

This course bundle combines all three of Schrödinger’s intermediate life science courses into one powerful program, designed to build practical expertise across the entire virtual screening pipeline.

Through this series you’ll gain hands-on experience with Schrödinger’s industry-leading Maestro and command-line interface. Ideal for scientists looking to enhance their practical skills in structure-based modeling, ligand library design, and virtual screening techniques. 

An opportunity to professionally develop, deepen drug discovery skills, and earn certifications and digital badges that demonstrate capabilities across all major stages of the target validation and hit discovery process.

  • Prepare and refine protein structures, including exercises with AlphaFold structures and cryptic pocket identification
  • Understand the vastness of chemical space, and design and filter ligand libraries using profiling and enumeration strategies
  • Execute virtual screening campaigns with Active Learning Glide and other advanced computational tools
  • Work through real-world case studies challenging your skills in each focus area
  • Learn on your own schedule with expert guidance and curated learning content

 

This course comes with temporary access to a web-based version of Schrödinger software, complete with licenses and compute resources

Requirements
  • A computer with reliable high speed internet access (8 Mbps or better)
  • A mouse and/or external monitor (recommended but not required)
  • Working knowledge of general chemistry
  • Working knowledge of Maestro. Please work through our Getting Going with Maestro resources to become familiar with using Maestro.
  • (Optional) Prior completion of the Introduction to molecular modeling in drug discovery online certification course.
Certification
  • A certificate signed by the Schrödinger course lead to add to your CV or resume
  • A badge that can be posted to social media, such as LinkedIn
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What you will learn

Target enablement and assessment

Prepare, assess, and refine experimental (X-ray, cryo-EM) and ML-predicted (AlphaFold, homology) structures. Identify druggable binding sites and characterize cryptic pockets

Library design

Explore chemical space, profile vendor libraries, and generate tailored in silico enumerated libraries. Learn strategies to filter libraries to remove liabilities while preserving diversity

Executing and validating virtual screens

Run pilot virtual screens, prepare receptor grids, apply known active enrichment validation techniques

Hit evaluation and prioritization

Evaluate and prioritize hits, including inspection and clustering. Scale screening with machine learning and AB-FEP+

Course syllabus

The course bundle includes access to the following three courses in their entirety during the single course session.

Designing quality ligand libraries
Target enablement, preparation, & validation
Virtual screening with integrated physics & machine learning

Need help obtaining funding for a Schrödinger Online Course?

We proudly support the next generation of scientists and are committed to providing opportunities to those with limited resources. Learn about your funding options for our online certification courses as a student, post-doc, or industry scientist and enroll today!

What our alumni say

“It is wonderful to have a group of high-quality professors teaching you computational chemistry. I think that the creation of ligand libraries in silico is an extremely useful skill in many circumstances. As a computational biologist it is gratifying to have this skill in my curriculum. Very grateful for the whole process, as always Schrödinger the best.”
Andres. R. Ch. PradaBiologist. M.Sc. Biostatistics. M.Sc. Computational Biology. Master in Molecular Biology, Andes University
“As a Data Engineer with a general background in software engineering, this course has had a hugely positive impact on my ability to collaborate with computational chemists. This course provided a valuable balance of theory and practice, giving me the scientific context necessary for making technical decisions when designing pipelines for my colleagues.”
Lillian Campbell
Lillian CampbellData Engineer, Oddity Labs
“The course was designed to tackle the pressing need of drug discovery acceleration when high precision protein prediction methods are readily available. I highly recommend this course.”
Wei WangAssistant Professor, Icahn School of Medicine
“The course was easy and enjoyable to follow, with background information that gives insight into how each technique is valued in modern drug discovery research. I now feel like an adept Maestro user and can steer my career towards molecular modeling with confidence.”
Joseph EganIntern, center of medicine research and innovation
“I had an amazing experience with the virtual working station! As a PhD candidate with a background in medicinal chemistry, the knowledge and skills I acquired in this course will benefit me in reaching my career goal.”
Sumaiya NahidGraduate Research Assistant, University of Nebraska Medical Center (UNMC)
“The course provided a comprehensive understanding of virtual screening methodologies that helped streamline my drug discovery process. It had a direct impact on the progress and success of my research projects.”
Abdulbasit Haliru YakubuPhD student, University of Southampton

Show off your newly acquired skills with a course badge and certificate

When you complete a course with us in molecular modeling and are ready to share what you learned with your colleagues and employers, you can share your certificate and badge on your LinkedIn profile.

Frequently asked questions

How much does the Hit discovery course bundle online course cost?

Pricing varies by each course and by the participant type. For students wishing to take this, we offer a student price of $500, and $1435 for non-students.

What time are the lectures?

Once the course session begins, all lectures are asynchronous and you can view the self-paced videos, tutorials, and assignments at your convenience. When registering for the course you will select the start and end date. Within those dates, you will have asynchronous access to the course material and virtual workstation to work on the course when it best suits your schedule.

How could I pay for this course?

Interested participants can pay for the course by completing their registration and using the credit card portal for an instant sign up. Please note that a credit card is required as we do not accept debit cards. Additionally, we can provide a purchase order upon request, please email online-learning@schrodinger.com if you are interested in this option. If you have any questions regarding how to pay for the course, please visit our funding options page.

How can I preview the course before registering?
Are there any scholarship opportunities available for students?

Schrödinger is committed to supporting students with limited resources. Schrödinger’s mission is to improve human health and quality of life by transforming the way therapeutics and materials are discovered. Schrödinger proudly supports the next generation of scientists. We have created a scholarship program that is open to full-time students or post-docs to students who can demonstrate financial need, and have a statement of support from the academic advisor. Please complete the application form if you qualify for our scholarship program!

Will material still be available after a course ends?

While access to the software will end when the course closes, some of the material within the course (slides, papers, and tutorials) are available for download so that you can refer back to it after the course. Other materials, such as videos, quizzes, and access to the software, will only be available for the duration of the course.

Do I need access to the software to be able to do the course? Do I have to purchase the software separately?

For the duration of the course, you will have access to a web-based version of Maestro, Bioluminate, Materials Science Maestro and/or LiveDesign (depending on the course). You do not have to separately purchase access to any software. While access to the software will end when the course closes, some of the material within the course (slides, papers, and tutorials) are available for download so that you can refer back to it after the course. Other materials, such as videos, quizzes, and access to the software, will only be available for the duration of the course. Please note that Schrödinger software is only to be used for course-related purposes.

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