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Disambiguation of "Gallicchio, Emilio"

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Asynchronous replica exchange for molecular simulations.

, , and . J. Comput. Chem., 29 (5): 788-794 (2008)

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Emilio Voigt

Emilio Francesquini

Emilio Vallina

Emilio Serra

Emilio Giannandrea

 

Other publications of authors with the same name

A grid-based algorithm in conjunction with a gaussian-based model of atoms for describing molecular geometry., , and . J. Comput. Chem., 40 (12): 1290-1304 (2019)A combined treatment of hydration and dynamical effects for the modeling of host-guest binding thermodynamics: the SAMPL5 blinded challenge., , , , , , , , , and . J. Comput. Aided Mol. Des., 31 (1): 29-44 (2017)Prediction of SAMPL3 host-guest affinities with the binding energy distribution analysis method (BEDAM)., and . J. Comput. Aided Mol. Des., 26 (5): 505-516 (2012)The Rutgers Computational Grid: A Distributed Linux PC Cluster., , , , and . Clust. Comput., 6 (3): 267-278 (2003)Asynchronous replica exchange software for grid and heterogeneous computing., , , , , , and . Comput. Phys. Commun., (2015)Massive-Scale Binding Free Energy Simulations of HIV Integrase Complexes Using Asynchronous Replica Exchange Framework Implemented on the IBM WCG Distributed Network., , , , , , , and . J. Chem. Inf. Model., 59 (4): 1382-1397 (2019)Relative Binding Free Energy Calculations for Ligands with Diverse Scaffolds with the Alchemical Transfer Method., , , , and . J. Chem. Inf. Model., 62 (2): 309-323 (2022)Validation of the Alchemical Transfer Method for the Estimation of Relative Binding Affinities of Molecular Series., , , , and . J. Chem. Inf. Model., 63 (8): 2438-2444 (April 2023)Integrated Modeling Program, Applied Chemical Theory (IMPACT)., , , , , , , , , and 8 other author(s). J. Comput. Chem., 26 (16): 1752-1780 (2005)FORTRAN routine to compute Born-Oppenheimer potential energy curves directly from spectroscopic data., and . J. Comput. Chem., 14 (5): 579-586 (1993)