Rethinking Molecular Design: Integrating Latent Variable and Auto-Regressive Models for Goal Directed Generation

Open weights ETH Zurich,University of Zurich,ETH AI Center August 2024

No estimate

No hardware requirements for this model

This model's weights are open, but no parameter count has been published for it. Every memory and speed figure starts from that number, so we would rather show nothing than a fabricated estimate.

On record

Full specification

Everything on record for this model. Most of it describes how it was trained rather than how it runs — useful context for judging how much work went into it, and how it compares with models built at a different scale.

Origin

Who built this model, where, and when it was published.

Organisation
ETH Zurich,University of Zurich,ETH AI Center
Organisation type
Academia,Academia,Research collective
Country
Switzerland
Published
19 August 2024
Authors
Heath Arthur-Loui, Amina Mollaysa, Michael Krauthammer

What it does

The problem areas the model was built for. A model can carry several of each.

Domain
Biology
Task
Drug discovery

Size

How large the model is and how much data it was trained on. Parameters are the figure that decides whether it fits on a given graphics card.

Training data
tokens

QM9 Dataset: 113,885 molecules × 40 tokens = 4,555,400 tokens ZINC250k Dataset: 250,000 molecules × 120 tokens = 30,000,000 tokens Total: 4,555,400 + 30,000,000 = 34,555,400 tokens ≈ 3.5 × 10^7 tokens

Epochs
500

Training compute

The arithmetic performed to train the model, measured in floating-point operations. It is a measure of what the training run cost, not of how fast the finished model answers you.

How it was established
Hardware

The training run

What it physically took to train: which chips, how many, for how long, and what that drew from the wall.

Training hardware
NVIDIA GeForce RTX 4090
Chips used
1
Power draw
487 W

Availability

Whether you can obtain the model and run it on your own hardware, which is what decides if any of the graphics-card figures on this page apply.

Weights
Open — downloadable
Model access
Open weights (non-commercial)
Training code
Open (non-commercial)

no clear license https://github.com/HeathArhturLouis/Rethinking-Molecular-Design-Integrating-Latent-Variable-and-Autoregressive-Models-for-Enhanced-Goal

How it is classified

Labels the source dataset applies when tracking notable models, and how confident it is in the entry.

Record confidence
Confident

Sources

Where this record came from and when it was last checked.

Reference
Rethinking Molecular Design: Integrating Latent Variable and Auto-Regressive Models for Goal Directed Generation
Last updated
28 November 2025

What the numbers mean

Background

Rethinking Molecular Design: Integrating Latent Variable and Auto-Regressive Models for Goal Directed Generation was published by ETH Zurich,University of Zurich,ETH AI Center, in Switzerland, in August 2024. academia,Academia,Research collective is the category the publisher falls under.

It works in Biology, and is recorded as doing drug discovery.

The weights being open is what puts this page in the calculator rather than only in the catalogue: it is a model you can actually hold.

Answers

Rethinking Molecular Design: Integrating Latent Variable and Auto-Regressive Models for Goal Directed Generation — common questions

01

What GPU do I need to run Rethinking Molecular Design: Integrating Latent Variable and Auto-Regressive Models for Goal Directed Generation?

We cannot say. Rethinking Molecular Design: Integrating Latent Variable and Auto-Regressive Models for Goal Directed Generation has open weights, but no parameter count has been published for it, and every memory and speed calculation starts from that number. We would rather show nothing than a fabricated estimate.

02

Is Rethinking Molecular Design: Integrating Latent Variable and Auto-Regressive Models for Goal Directed Generation open source?

Its weights are published, so Rethinking Molecular Design: Integrating Latent Variable and Auto-Regressive Models for Goal Directed Generation can be downloaded and run on your own hardware. Note that open weights is not the same as open source in the full sense — it says nothing about the training data, the training code, or the commercial terms attached.

03

How many parameters does Rethinking Molecular Design: Integrating Latent Variable and Auto-Regressive Models for Goal Directed Generation have?

No parameter count has been published for Rethinking Molecular Design: Integrating Latent Variable and Auto-Regressive Models for Goal Directed Generation, which is why no memory or speed figure appears on this page.

04

Who created Rethinking Molecular Design: Integrating Latent Variable and Auto-Regressive Models for Goal Directed Generation?

Rethinking Molecular Design: Integrating Latent Variable and Auto-Regressive Models for Goal Directed Generation was published by ETH Zurich,University of Zurich,ETH AI Center, based in Switzerland, categorised as academia,Academia,Research collective.

05

When was Rethinking Molecular Design: Integrating Latent Variable and Auto-Regressive Models for Goal Directed Generation released?

Rethinking Molecular Design: Integrating Latent Variable and Auto-Regressive Models for Goal Directed Generation was published in August 2024. Capability per parameter has improved considerably since, so a newer model of the same size is often the better use of the same hardware.

06

What is Rethinking Molecular Design: Integrating Latent Variable and Auto-Regressive Models for Goal Directed Generation used for?

Rethinking Molecular Design: Integrating Latent Variable and Auto-Regressive Models for Goal Directed Generation works in Biology, and is recorded as handling drug discovery. Models frequently carry more than one of each, and the tags describe purpose rather than capability limits.

07

Where can I download Rethinking Molecular Design: Integrating Latent Variable and Auto-Regressive Models for Goal Directed Generation?

The weights for Rethinking Molecular Design: Integrating Latent Variable and Auto-Regressive Models for Goal Directed Generation are published, though we do not hold a repository link for it. This site calculates hardware requirements rather than hosting model files.

Source

Original publication

Record last updated 28 November 2025

The other direction

Looking at it from the other side?

This page starts from the model. If you already own a card and want to know everything it will run, start from the hardware instead.