Media Summary: Lecture given by Prof. Pavlo Dral, 04Nov2025, in Advanced Techniques on An extended version of my talk at the APS March Meeting 2021 on generative model DDPS Talk date: January 24th, 2024 Speaker: Max Welling (University of Amsterdam,

Machine Learning Applied To Molecular - Detailed Analysis & Overview

Lecture given by Prof. Pavlo Dral, 04Nov2025, in Advanced Techniques on An extended version of my talk at the APS March Meeting 2021 on generative model DDPS Talk date: January 24th, 2024 Speaker: Max Welling (University of Amsterdam, Recorded 25 January 2023. Stefan Chmiela of the Technische Universität Berlin, In a little over 2 minutes, I will be explaining how All of the Fully Connected London 2024 videos are available at *About Marc Osterland's Session ...

Dr. Ariane F. Nunes-Alves exposed us to how PyData London Meetup Tuesday, July 3, 2018 At GTN we are combining ideas from quantum physics and chemistry with ... Recorded 23 January 2023. Frank Noe of Freie Universität Berlin presents "Advancing ... welling with us today today he will be sharing his insights on SMLQC seminar. Max Pinheiro Jr, 16 February 2023. Nonadiabatic In this video, I explain my master's thesis project on accelerating

Lennard-Jones Centre discussion group seminar by Prof. Rocio Semino from the Sorbonne University in France. Metal-organic ...

Photo Gallery

Lecture 5: Deep Learning for Molecules
“Machine Learning applied to Molecular Dynamics”
Machine Learning Meets Molecular Dynamics: A Crash Course in MLIPs for Solids
Lecture 10: Reinforcement Learning for Molecules
Machine learning for molecular electronics
Machine Learning in Drug Discovery: Francesca Grisoni
DDPS | “Machine Learning for Molecules and Materials”
Patrick Riley: "Reinforcement learning for molecular generation"
Molecular Machine Learning
Stefan Chmiela - Accurate global machine learning force fields for molecules with hundreds of atoms
Machine Learning for Drug Discovery (Explained in 2 minutes)
Machine learning in drug discovery at Bayer Pharmaceuticals: from models to molecules
View Detailed Profile
Lecture 5: Deep Learning for Molecules

Lecture 5: Deep Learning for Molecules

Deep

“Machine Learning applied to Molecular Dynamics”

“Machine Learning applied to Molecular Dynamics”

Lecture given by Prof. Pavlo Dral, 04Nov2025, in Advanced Techniques on

Machine Learning Meets Molecular Dynamics: A Crash Course in MLIPs for Solids

Machine Learning Meets Molecular Dynamics: A Crash Course in MLIPs for Solids

This video provides an intro to

Lecture 10: Reinforcement Learning for Molecules

Lecture 10: Reinforcement Learning for Molecules

A first step towards learning how to

Machine learning for molecular electronics

Machine learning for molecular electronics

An extended version of my talk at the APS March Meeting 2021 on generative model

Machine Learning in Drug Discovery: Francesca Grisoni

Machine Learning in Drug Discovery: Francesca Grisoni

...

DDPS | “Machine Learning for Molecules and Materials”

DDPS | “Machine Learning for Molecules and Materials”

DDPS Talk date: January 24th, 2024 Speaker: Max Welling (University of Amsterdam, https://staff.fnwi.uva.nl/m.welling/) ...

Patrick Riley: "Reinforcement learning for molecular generation"

Patrick Riley: "Reinforcement learning for molecular generation"

Machine Learning

Molecular Machine Learning

Molecular Machine Learning

This video gives an introduction to

Stefan Chmiela - Accurate global machine learning force fields for molecules with hundreds of atoms

Stefan Chmiela - Accurate global machine learning force fields for molecules with hundreds of atoms

Recorded 25 January 2023. Stefan Chmiela of the Technische Universität Berlin,

Machine Learning for Drug Discovery (Explained in 2 minutes)

Machine Learning for Drug Discovery (Explained in 2 minutes)

In a little over 2 minutes, I will be explaining how

Machine learning in drug discovery at Bayer Pharmaceuticals: from models to molecules

Machine learning in drug discovery at Bayer Pharmaceuticals: from models to molecules

All of the Fully Connected London 2024 videos are available at http://wandb.me/fclondon24yt* *About Marc Osterland's Session ...

EAIFR Webinar on Molecular Dynamics, Enhanced Sampling and Machine Learning: Dr.  Ariane Nunes-Alves

EAIFR Webinar on Molecular Dynamics, Enhanced Sampling and Machine Learning: Dr. Ariane Nunes-Alves

Dr. Ariane F. Nunes-Alves exposed us to how

Michael Craig - Machine Learning on molecular data

Michael Craig - Machine Learning on molecular data

PyData London Meetup #46 Tuesday, July 3, 2018 At GTN we are combining ideas from quantum physics and chemistry with ...

Frank Noe - Advancing molecular simulation with deep learning - IPAM at UCLA

Frank Noe - Advancing molecular simulation with deep learning - IPAM at UCLA

Recorded 23 January 2023. Frank Noe of Freie Universität Berlin presents "Advancing

Max Welling, Machine Learning for Molecules and Materials

Max Welling, Machine Learning for Molecules and Materials

... welling with us today today he will be sharing his insights on

Max Pinheiro Jr | Nonadiabatic Molecular Dynamics with Machine Learning | Lecture

Max Pinheiro Jr | Nonadiabatic Molecular Dynamics with Machine Learning | Lecture

SMLQC seminar. Max Pinheiro Jr, 16 February 2023. Nonadiabatic

Accelerating Molecular Docking with PyTorch | My Master’s Thesis

Accelerating Molecular Docking with PyTorch | My Master’s Thesis

In this video, I explain my master's thesis project on accelerating

Order-disorder transitions in zeolitic frameworks using molecular dynamics and machine learning

Order-disorder transitions in zeolitic frameworks using molecular dynamics and machine learning

Lennard-Jones Centre discussion group seminar by Prof. Rocio Semino from the Sorbonne University in France. Metal-organic ...