Mikko Karttunen

Publication Activity (10 Years)

Years Active: 2004-2024
Publications (10 Years): 11

Top Topics

Molecular Dynamics

Dynamic Behavior

Top Venues

J. Chem. Inf. Model.

Comput. Phys. Commun.

Publications

Anupom Roy, Mikko Karttunen
A Molecular Dynamics Simulation Study of the Effects of βGln114 Mutation on the Dynamic Behavior of the Catalytic Site of the Tryptophan Synthase. J. Chem. Inf. Model. 64 (3) (2024)
Elham Kiyani, Mahdi Kooshkbaghi, Khemraj Shukla, Rahul Babu Koneru, Zhen Li, Luis Bravo, Anindya Ghoshal, George Em Karniadakis, Mikko Karttunen
Characterization of partial wetting by CMAS droplets using multiphase many-body dissipative particle dynamics and data-driven discovery based on PINNs. CoRR (2023)
Elham Kiyani, Khemraj Shukla, George Em Karniadakis, Mikko Karttunen
A Framework Based on Symbolic Regression Coupled with eXtended Physics-Informed Neural Networks for Gray-Box Learning of Equations of Motion from Data. CoRR (2023)
Elham Kiyani, Hamidreza Yazdani Sarvestani, Hossein Ravanbakhsh, Razyeh Behbahani, Behnam Ashrafi, Meysam Rahmat, Mikko Karttunen
Designing architectured ceramics for transient thermal applications using finite element and deep learning. CoRR (2023)
Cecilia Chávez-García, Jérôme Hénin, Mikko Karttunen
Multiscale Computational Study of the Conformation of the Full-Length Intrinsically Disordered Protein MeCP2. J. Chem. Inf. Model. 62 (4) (2022)
Razyeh Behbahani, Hamidreza Yazdani Sarvestani, Erfan Fatehi, Elham Kiyani, Behnam Ashrafi, Mikko Karttunen, Meysam Rahmat
Machine Learning-Driven Process of Alumina Ceramics Laser Machining. CoRR (2022)
Cecilia Chávez-García, Mikko Karttunen
Highly Similar Sequence and Structure Yet Different Biophysical Behavior: A Computational Study of Two Triosephosphate Isomerases. J. Chem. Inf. Model. 62 (3) (2022)
Rafael Maglia de Souza, Mikko Karttunen, Mauro Carlos Costa Ribeiro
Fine-Tuning the Polarizable CL&Pol Force Field for the Deep Eutectic Solvent Ethaline. J. Chem. Inf. Model. 61 (12) (2021)
Rafael Maglia de Souza, Leonardo José Amaral de Siqueira, Mikko Karttunen, Luis Gustavo Dias
Molecular Dynamics Simulations of Polymer-Ionic Liquid (1-Ethyl-3-methylimidazolium Tetracyanoborate) Ternary Electrolyte for Sodium and Potassium Ion Batteries. J. Chem. Inf. Model. 60 (2) (2020)
Rafael Maglia de Souza, R. H. Ratochinski, Mikko Karttunen, Luis Gustavo Dias
Self-Assembly of Phosphocholine Derivatives Using the ELBA Coarse-Grained Model: Micelles, Bicelles, and Reverse Micelles. J. Chem. Inf. Model. 60 (2) (2020)
Pranav Madhikar, Jan Åström, Jan Westerholm, Mikko Karttunen
GPU accelerated software for simulations of cellular growth and division in three dimensions. Comput. Phys. Commun. 232 (2018)
Teemu Hynninen, Cristiano L. Dias, A. Mkrtchyan, Vili Heinonen, Mikko Karttunen, Adam S. Foster, Tapio Ala-Nissila
A molecular dynamics implementation of the 3D Mercedes-Benz water model. Comput. Phys. Commun. 183 (2) (2012)
Timo Vuorela, Andrea Catte, Perttu S. Niemelä, Anette Hall, Marja T. Hyvönen, Siewert J. Marrink, Mikko Karttunen, Ilpo Vattulainen
Role of Lipids in Spheroidal High Density Lipoproteins. PLoS Comput. Biol. 6 (10) (2010)
Perttu S. Niemelä, Samuli Ollila, Marja T. Hyvönen, Mikko Karttunen, Ilpo Vattulainen
Assessing the Nature of Lipid Raft Membranes. PLoS Comput. Biol. 3 (2) (2007)
Michael Patra, Marja T. Hyvönen, Emma Falck, Mohsen Sabouri-Ghomi, Ilpo Vattulainen, Mikko Karttunen
Long-range interactions and parallel scalability in molecular simulations. Comput. Phys. Commun. 176 (1) (2007)
Michael Patra, Mikko Karttunen
Systematic comparison of force fields for microscopic simulations of NaCl in aqueous solutions: Diffusion, free energy of hydration, and structural properties. J. Comput. Chem. 25 (5) (2004)