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Abdulkadir Kocak

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Category: Physical Chemistry

Modeling Gas Adsorption and Mechanistic Insights into Flexibility in Isoreticular Metal–Organic Frameworks using High-Dimensional Neural Network Potentials

, Authors: Omer Tayfuroglu, Yunus Zorlu, Abdulkadir Kocak

Version 1 posted 14 November 2023

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Category: Physical Chemistry

DeepConf: Leveraging ANI-ML Potentials for Exploring Local Minima with A Focus on Bioactive Conformations

, Authors: Omer Tayfuroglu, İrem Nur Zengin, Mehmet Serdar Koca, Abdulkadir Kocak

Version 1 posted 22 November 2024

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ISSN 2573-2293 (Online) ChemRxiv Archive

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