Saientan Bag

7PUBLICATIONS
12CO-AUTHORS
Computational chemistryNumerical modelling and mechanical characterisationTheoretical quantum chemistryColloid and surface chemistryBiologically active molecules
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Publications (7)

|Apr 09, 2024
Synthetic Force-Field Database for Training Machine Learning Models to Predict Mobility-Preserving Coarse-Grained Molecular-Simulation Potentials.

Saientan Bag, Melissa K Meinel, Florian Müller-Plathe

|Nov 30, 2022
Toward a Mobility-Preserving Coarse-Grained Model: A Data-Driven Approach.

Saientan Bag, Melissa K Meinel, Florian Müller-Plathe

|Oct 08, 2021
Fast Generation of Machine Learning-Based Force Fields for Adsorption Energies.

Saientan Bag, Manuel Konrad, Tobias Schlöder

|Sep 22, 2021
Insights on Alanine and Arginine Binding to Silica with Atomic Resolution.

Stefan Rauwolf, Saientan Bag, Rodrigo Rouqueiro

|May 05, 2021
DNA Binding to the Silica: Cooperative Adsorption in Action.

Saientan Bag, Stefan Rauwolf, Sebastian P Schwaminger

|Sep 03, 2020
Machine Learning Prediction of Electronic Coupling between the Guanine Bases of DNA.

Saientan Bag, Abhishek Aggarwal, Prabal K Maiti

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