Timothy J. Giese
Orcid: 0000-0002-0653-9168
According to our database1,
Timothy J. Giese
authored at least 7 papers
between 2008 and 2023.
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Bibliography
2023
2022
AMBER Drug Discovery Boost Tools: Automated Workflow for Production Free-Energy Simulation Setup and Analysis (ProFESSA).
J. Chem. Inf. Model., 2022
2021
CHARMM-GUI Free Energy Calculator for Practical Ligand Binding Free Energy Simulations with AMBER.
J. Chem. Inf. Model., 2021
2020
Alchemical Binding Free Energy Calculations in AMBER20: Advances and Best Practices for Drug Discovery.
J. Chem. Inf. Model., 2020
2018
GPU-Accelerated Molecular Dynamics and Free Energy Methods in Amber18: Performance Enhancements and New Features.
J. Chem. Inf. Model., 2018
2015
Nucleic acid reactivity: Challenges for next-generation semiempirical quantum models.
J. Comput. Chem., 2015
2008
Extension of adaptive tree code and fast multipole methods to high angular momentum particle charge densities.
J. Comput. Chem., 2008