Lars A Bratholm

Scopus Author ID ORCID

Publication Activity (10 Years)

Years Active: 2016-2024
Publications (10 Years): 7

Top Venues

Chemical science

Journal of chemical information and modeling

PloS one

The Journal of chemical physics

University of Bristol

This page only lists publications with an associated author ORCID identifier.

Affiliation History

University of Bristol Sep 01 2017

United Kingdom

Research Associate :: Maths

University of Copenhagen

Denmark

PhD student :: Chemistry

Publications

Michael J Bakker, Amina Gaffour, Martin Juhás, Vojtěch Zapletal, Jakub Stošek, Lars A Bratholm, Jana Pavlíková Přecechtělová
Streamlining NMR Chemical Shift Predictions for Intrinsically Disordered Proteins: Design of Ensembles with Dimensionality Reduction and Clustering. Journal of chemical information and modeling (2024)
Michael J Bakker, Amina Gaffour, Martin Juhás, Vojtěch Zapletal, Jakub Stošek, Lars A Bratholm, Jana Pavlíková Přecechtělová
Streamlining NMR Chemical Shift Predictions for Intrinsically Disordered Proteins: Design of Ensembles with Dimensionality Reduction and Clustering. Journal of chemical information and modeling 64 (16) (2024)
Lars A Bratholm, Will Gerrard, Brandon Anderson, Shaojie Bai, Sunghwan Choi, Lam Dang, Pavel Hanchar, Addison Howard, Sanghoon Kim, Zico Kolter, Risi Kondor, Mordechai Kornbluth, Youhan Lee, Youngsoo Lee, Jonathan P Mailoa, Thanh Tu Nguyen, Milos Popovic, Goran Rakocevic, Walter Reade, Wonho Song, Luka Stojanovic, Erik H Thiede, Nebojsa Tijanic, Andres Torrubia, Devin Willmott, Craig P Butts, David R Glowacki
A community-powered search of machine learning strategy space to find NMR property prediction models. PloS one 16 (7) (2021)
Silvia Amabilino, Lars A Bratholm, Simon J Bennie, Michael B O'Connor, David R Glowacki
Training atomic neural networks using fragment-based data generated in virtual reality. The Journal of chemical physics 153 (15) (2020)
Silvia Amabilino, Lars A Bratholm, Simon J Bennie, Alain Claude Vaucher, Markus Reiher, David R Glowacki
Training Neural Nets To Learn Reactive Potential Energy Surfaces Using Interactive Quantum Chemistry in Virtual Reality. The journal of physical chemistry. A 123 (20) (2019)
Will Gerrard, Lars A Bratholm, Martin J Packer, Adrian J Mulholland, David R Glowacki, Craig P Butts
IMPRESSION - prediction of NMR parameters for 3-dimensional chemical structures using machine learning with near quantum chemical accuracy. Chemical science 11 (2) (2019)
Lars A Bratholm, Jan H Jensen
Protein structure refinement using a quantum mechanics-based chemical shielding predictor. Chemical science 8 (3) (2016)

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Publication Activity (10 Years)

Top Topics

Top Venues

Lars A Bratholm