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Frontiers in Molecular Biosciences
|
July 7, 2020
Recent Developments in Linear Interaction Energy Based Binding Free Energy Calculations
Eko Aditya Rifai, Marc van Dijk, Daan P Geerke
Journal of Chemical Theory and Computation
|
January 3, 2020
Combined Linear Interaction Energy and Alchemical Solvation Free-Energy Approach for Protein-Binding Affinity Computation
Eko Aditya Rifai, Valerio Ferrario, Jürgen Pleiss, et al.
Journal of Computer-Aided Molecular Design
|
September 11, 2017
Binding free energy predictions of farnesoid X receptor (FXR) agonists using a linear interaction energy (LIE) approach with reliability estimation: application to the D3R Grand Challenge 2
Eko Aditya Rifai, Marc van Dijk, Nico P E Vermeulen, et al.
Scientific Reports
|
October 15, 2021
Two triterpenoids from Rubus fraxinifolius leaves and their tyrosinase and elastase inhibitory activities
Yesi Desmiaty, Muhammad Hanafi, Fadlina Chany Saputri, et al.
Journal of Chemical Information and Modeling
|
August 29, 2019
A Comparative Linear Interaction Energy and MM/PBSA Study on SIRT1-Ligand Binding Free Energy Calculation
Eko Aditya Rifai, Marc van Dijk, Nico P E Vermeulen, et al.
Page
of 1
Search research articles
Search
Showing results (1-10 of 5) with videos related to
Sort By:
Page
of 1
Frontiers in Molecular Biosciences
|
July 7, 2020
Recent Developments in Linear Interaction Energy Based Binding Free Energy Calculations
Eko Aditya Rifai, Marc van Dijk, Daan P Geerke
Journal of Chemical Theory and Computation
|
January 3, 2020
Combined Linear Interaction Energy and Alchemical Solvation Free-Energy Approach for Protein-Binding Affinity Computation
Eko Aditya Rifai, Valerio Ferrario, Jürgen Pleiss, et al.
Journal of Computer-Aided Molecular Design
|
September 11, 2017
Binding free energy predictions of farnesoid X receptor (FXR) agonists using a linear interaction energy (LIE) approach with reliability estimation: application to the D3R Grand Challenge 2
Eko Aditya Rifai, Marc van Dijk, Nico P E Vermeulen, et al.
Scientific Reports
|
October 15, 2021
Two triterpenoids from Rubus fraxinifolius leaves and their tyrosinase and elastase inhibitory activities
Yesi Desmiaty, Muhammad Hanafi, Fadlina Chany Saputri, et al.
Journal of Chemical Information and Modeling
|
August 29, 2019
A Comparative Linear Interaction Energy and MM/PBSA Study on SIRT1-Ligand Binding Free Energy Calculation
Eko Aditya Rifai, Marc van Dijk, Nico P E Vermeulen, et al.
Page
of 1