Search research articles

ABOUT JoVE

Overview Leadership Blog JoVE Help Center

AUTHORS

Publishing Process Editorial Board Scope & Policies Peer Review FAQ Submit

LIBRARIANS

Testimonials Subscriptions Access Resources Library Advisory Board FAQ

RESEARCH

JoVE Journal Methods Collections JoVE Encyclopedia of Experiments Archive

EDUCATION

JoVE Core JoVE Business JoVE Science Education JoVE Lab Manual Faculty Resource Center Faculty Site

Terms & Conditions of Use

Eric M Collins

6PUBLICATIONS

1CO-AUTHORS

Geospatial information systems and geospatial data modellingComputational chemistryTheoretical quantum chemistryDeep learning

Featured researcher

Get your video featured.

Publish with JoVE

Featured researcher

Get your video featured.

Publish with JoVE

Publications (6)

Sort by Publication Date:

|Apr 17, 2024

Stepping-Stone CBH: Benchmark and Application of a Multilayered Isodesmic-Based Correction Scheme.

Eric M Collins, Krishnan Raghavachari

|Jun 20, 2023

Approaching Coupled Cluster Accuracy with Density Functional Theory Using the Generalized Connectivity-Based Hierarchy.

Krishnan Raghavachari, Sarah Maier, Eric M Collins

|May 03, 2023

Interpretable Graph-Network-Based Machine Learning Models via Molecular Fragmentation.

Eric M Collins, Krishnan Raghavachari

|Apr 04, 2023

Quantitative Prediction of Vertical Ionization Potentials from DFT via a Graph-Network-Based Delta Machine Learning Model Incorporating Electronic Descriptors.

Sarah Maier, Eric M Collins, Krishnan Raghavachari

|Aug 03, 2021

A Fragmentation-Based Graph Embedding Framework for QM/ML.

Eric M Collins, Krishnan Raghavachari

|Jul 18, 2020

Effective Molecular Descriptors for Chemical Accuracy at DFT Cost: Fragmentation, Error-Cancellation, and Machine Learning.

Eric M Collins, Krishnan Raghavachari

Pageof 1

Frequent Collaborators

6 joint publications

Krishnan Raghavachari

Frequent Collaborators

6 joint publications

Krishnan Raghavachari

Top Related Videos

Multimodal Cross-Device and Marker-Free Co-Registration of Preclinical Imaging Modalities

Multimodal Cross-Device and Marker-Free Co-Registration of Preclinical Imaging Modalities

Published on : Oct 27, 2023

Computation of Atmospheric Concentrations of Molecular Clusters from <em>ab initio</em> Thermochemistry

Computation of Atmospheric Concentrations of Molecular Clusters from <em>ab initio</em> Thermochemistry

Published on : Apr 08, 2020

Mass Spectrometry-Guided Genome Mining as a Tool to Uncover Novel Natural Products

Mass Spectrometry-Guided Genome Mining as a Tool to Uncover Novel Natural Products

Published on : Mar 12, 2020

See more related videos

Top Related Videos

Multimodal Cross-Device and Marker-Free Co-Registration of Preclinical Imaging Modalities

Multimodal Cross-Device and Marker-Free Co-Registration of Preclinical Imaging Modalities

Published on : Oct 27, 2023

Computation of Atmospheric Concentrations of Molecular Clusters from <em>ab initio</em> Thermochemistry

Computation of Atmospheric Concentrations of Molecular Clusters from <em>ab initio</em> Thermochemistry

Published on : Apr 08, 2020

Mass Spectrometry-Guided Genome Mining as a Tool to Uncover Novel Natural Products

Mass Spectrometry-Guided Genome Mining as a Tool to Uncover Novel Natural Products

Published on : Mar 12, 2020

See more related videos