Lukas Herron - Publications, H-index & Citations

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Lukas Herron

University of Maryland

8H-index

23Paper Count

251Citation Count

Published Papers 7

Publication Date

DiffDock-Glide: A Hybrid Physics-Based and Data-Driven Approach to Molecular Docking

Journal of Chemical Information and Modeling

IF5.3

2026-04-23

PREAI

Lukas Herron; Jumana Dakka; Steven V. Jerome; Kun Yao; Da Shi

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Latent thermodynamic flows: unified representation learning and generative modeling of temperature-dependent behaviors from limited data

chem. sci.

IF0

2026-01-03

OAAI

Yunrui Qiu; Richard John; Lukas Herron; Pratyush Tiwary

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A comparison of probabilistic generative frameworks for molecular simulations

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2025-03-21

PREAI

John, Richard; Herron, Lukas; Tiwary, Pratyush

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Designing host-associated microbiomes using the consumer/resource model

MSYSTEMS

IF4.6

2025-01-21

PREAI

Plata, German; Srinivasan, Karthik; Krishnamurthy, Madan; Herron, Lukas; Dixit, Purushottam

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Inferring phase transitions and critical exponents from limited observations with thermodynamic maps

PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

IF9.1

2024-12-16

OAAI

Herron, Lukas; Mondal, Kinjal; Schneekloth, John S.; Tiwary, Pratyush

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Enhanced Sampling with Machine Learning

ANNUAL REVIEW OF PHYSICAL CHEMISTRY

IF11.7

2024-06-28

OAAI

Mehdi, Shams; Smith, Zachary; Herron, Lukas; Zou, Ziyue; Tiwary, Pratyush

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From data to noise to data for mixing physics across temperatures with generative artificial intelligence

PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

IF9.1

2022-08-04

OAAI

Wang, Yihang; Herron, Lukas; Tiwary, Pratyush

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Research Directions