Author of the publication

Alchemical Free Energy Methods Applied to Complexes of the First Bromodomain of BRD4.

, , , , and . J. Chem. Inf. Model., 62 (6): 1458-1470 (2022)

Please choose a person to relate this publication to

To differ between persons with the same name, the academic degree and the title of an important publication will be displayed. You can also use the button next to the name to display some publications already assigned to the person.

 

Other publications of authors with the same name

Efficient in silico exploration of RNA interhelical conformations using Euler angles and WExplore, , , and . Nucleic Acids Research, (2014)Editors' note., , and . J. Comput. Chem., 30 (1): 1 (2009)lambda-Dynamics free energy simulation methods., and . J. Comput. Chem., 30 (11): 1692-1700 (2009)Modern protein force fields behave comparably in molecular dynamics simulations., and . J. Comput. Chem., 23 (11): 1045-1057 (2002)Efficient implementation of constant pH molecular dynamics on modern graphics processors., and . J. Comput. Chem., 37 (24): 2171-2180 (2016)Efficient approximate all-atom solvent accessible surface area method parameterized for folded and denatured protein conformations., and . J. Comput. Chem., 25 (8): 1005-1014 (2004)Letter from the Editors., , and . J. Comput. Chem., 28 (11): 1775 (2007)Detailed considerations for a balanced and broadly applicable force field: A study of substituted benzenes modeled with OPLS-AA., and . J. Comput. Chem., 26 (14): 1529-1541 (2005)CDOCKER and λ-dynamics for prospective prediction in D3R Grand Challenge 2., , , , and . J. Comput. Aided Mol. Des., 32 (1): 89-102 (2018)Comparative study of several algorithms for flexible ligand docking., , , and . J. Comput. Aided Mol. Des., 17 (11): 755-763 (2003)