Laboratory of Mihaly Mezei

Software MMC LOGO MMC:  Monte Carlo simulations: (T,V,N), (T,P,N), (T,V,µ) ensembles; free energy; Proximity Analysis
Simulaid LOGO Simulaid: simulation setup utilities:
optimal solute placement, conversions and analysis
Dockres LOGO Fullscreen and Dockres: Virtual screening utilities
and their analyses
Cham LOGO PFP: Protein fingerprint generation
Cham LOGO Cham: Search for chameleon sequences
CVdistr LOGO Cvdistr: Molecular sphericity calculation
Pspace LOGO Pspace: Protein space covering
Rescore LOGO Rescore: ClusPro and PatchDock result analysis
Atomc LOGO Atomc: multi ensemble atomic fluid Monte Carlo
Gibbs LOGO Gibbs: cavity-biased Gibbs ensemble Monte Carlo
Maxwell LOGO Maxwell: multipole expansion for fluid and crystalline phase with the Maxwell formalism
Simloc LOGO Simloc: detection of local similarities between conformations
Intocham LOGO Intocham: conversion from InsightII to Charmm, Amber or Moil formats

Mezei Lab Home Projects Papers Software Molecular Modeling

Last modified: 11/07/2016 (MM)


Old Laboratory URLs: fulcrum.physbio.mssm.edu/~mezei, atlas.physbio.mssm.edu/~mezei, scbx.mssm.edu/mezeilab