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Raymond Poirier

7PUBLICATIONS

11CO-AUTHORS

Deep learningTheoretical quantum chemistryCheminformatics and quantitative structure-activity relationshipsNanomaterialsPharmacogenomics

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Publications (7)

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|Oct 27, 2025

ReMLP-NET: A Neural Network Interaction Potential for Molecular Energy Prediction.

Omid Tarkhaneh, Sharene D Bungay, Robert C Mawhinney

|Sep 10, 2025

Predicting HOMO-LUMO Gaps Using Hartree-Fock Calculated Data and Machine Learning Models.

Md Mehedi Hasan, Omid Tarkhaneh, Sharene D Bungay

|Dec 23, 2024

Evaluating the Anticancer Properties of Novel Piscidinol A Derivatives: Insights from DFT, Molecular Docking, and Molecular Dynamics Studies.

Humaera Noor Suha, Syed Ahmed Tasnim, Shofiur Rahman

|May 28, 2024

<i>In Silico</i> Discovery and Predictive Modeling of Novel Acetylcholinesterase (AChE) Inhibitors for Alzheimer's Treatment.

Humaera Noor Suha, Md Shamim Hossain, Shofiur Rahman

|Feb 08, 2022

Accelerating the discovery of the beyond rule of five compounds that have high affinities toward SARS-CoV-2 spike RBD.

Abd Al-Aziz A Abu-Saleh, Arpita Yadav, Raymond A Poirier

|Aug 25, 2020

Molecular level investigation of curcumin self-assembly induced by trigonelline and nanoparticle formation.

Sweta Sharma, Ibrahim E Awad, Arpita Yadav

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Frequent Collaborators

2 joint publications

Arpita Yadav

2 joint publications

Shofiur Rahman

2 joint publications

Abdullah Alodhayb

2 joint publications

Kabir M Uddin

2 joint publications

Sharene D Bungay

1 joint publications

Abd Al-Aziz A Abu-Saleh

1 joint publications

Syed Ahmed Tasnim

1 joint publications

Md Mehedi Hasan

1 joint publications

Shahidul M Islam

1 joint publications

Robert C Mawhinney

Frequent Collaborators

2 joint publications

Arpita Yadav

2 joint publications

Shofiur Rahman

2 joint publications

Abdullah Alodhayb

2 joint publications

Kabir M Uddin

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