BindGPT: A Scalable Framework for 3D Molecular Design via Language
Modeling and Reinforcement Learning

BindGPT: A Scalable Framework for 3D Molecular Design via Language Modeling and Reinforcement Learning

6 June 2024

Maksim Kuznetsov

Rim Shayakhmetov

Daniil Polykovskiy

Alex Zhavoronkov

Papers citing "BindGPT: A Scalable Framework for 3D Molecular Design via Language Modeling and Reinforcement Learning"

6 / 6 papers shown

Title
Bio2Token: All-atom tokenization of any biomolecular structure with Mamba Andrew Liu Axel Elaldi Nathan Russell Olivia Viessmann Mamba 63 2 0 24 Oct 2024
DiffDock: Diffusion Steps, Twists, and Turns for Molecular Docking Gabriele Corso Hannes Stärk Bowen Jing Regina Barzilay Tommi Jaakkola DiffM 139 409 0 04 Oct 2022
A 3D Generative Model for Structure-Based Drug Design Shitong Luo Jiaqi Guan Jianzhu Ma Jian-wei Peng DiffM 67 178 0 20 Mar 2022
Keeping it Simple: Language Models can learn Complex Molecular Distributions Daniel Flam-Shepherd Kevin Zhu A. Aspuru‐Guzik 131 142 0 06 Dec 2021
Scaling Laws for Neural Language Models Jared Kaplan Sam McCandlish T. Henighan Tom B. Brown B. Chess R. Child Scott Gray Alec Radford Jeff Wu Dario Amodei 231 4,460 0 23 Jan 2020
On Large-Batch Training for Deep Learning: Generalization Gap and Sharp Minima N. Keskar Dheevatsa Mudigere J. Nocedal M. Smelyanskiy P. T. P. Tang ODL 281 2,888 0 15 Sep 2016