Application for Workshop: "Deep Modeling for Molecular Simulation 2024"

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The Deep Modeling for Molecular Simulation workshop will take place on June 25-28, 2024 in the Department of Chemistry at Princeton University, Princeton, New Jersey. The event will be fully in person and is targeted at PhD students and young postdocs eager to learn more about deep modeling for molecular simulation. During the four days, we will have lectures in the mornings and hands-on sessions in the afternoons.

Please make sure to bring your own laptops.

The hands-on sessions will cover state-of-the-art topics in the application of deep learning to molecular simulations including:

electronic structure calculations (Quantum ESPRESSO),
learning of the ab initio potential energy surface (DeePMD-kit)
learning of electronic Wannier centers (Wannier90 + DeePMD-kit)
training models with long-range interactions (DeePMD-kit)
enhanced sampling methods (Plumed) and new Committor Methods

You can watch videos of the virtual workshop we organized in 2022 on YouTube and access last year's tutorials on GitHub.

The cost of lodging will be around $75/night. We will provide coffee, breakfast/lunch, and necessary computer time. We are also planning to have a social dinner and a poster session. Virtual machines with state-of-the art GPUs will be provided with pre-installed software. We are planning to accept only around 35 participants, and therefore the selection may be competitive. To maximize your chances, please answer our questions carefully below.

The deadline for receiving applications is Extended To May 3rd!

We will contact applicants shortly afterwards.

We are looking forward to seeing many of you in Princeton for four days of learning and fun!

The Organizers

Ryan Szukalo, Clarice Gethers, and Roberto Car

First Name *

Last Name *

Email Address

Institution (University, Company, etc.) *

Current Position *

Undergraduate Student

Graduate Student

Postdoc

Lecturer

Professor

Researcher/Scientist

Other:

Advisor(s) (if Graduate Student or Postdoc)

Describe your past experience with machine learning and molecular simulations. You can also describe the current project you are working on, or planning to work on. (please be thorough! Remember that selection may be competitive)
*

Describe the reasons for attending this workshop. How will the skills acquired at the workshop be used in your current or future research? (please be thorough! Remember that selection may be competitive)

Are you planning to attend the full four days of the workshop? *

Yes

Other:

Will you present a poster at the poster session? *

Yes

Maybe

What is your country of origin? *

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