The Lab
Principal Investigator
Our labs are located in the Interdisciplinary Science and Engineering Complex (ISEC) on Northeastern’s Boston Campus.
The O.R.G. has access to high performances machines and remote servers for large computational jobs, in addition to our local workstations. Here are a few programs that individuals in our group use for various research projects:
Functional Site Predictors (ORG Servers)
THEoretical Microscopic Anomalous TItration Curves (THEMATICS)
Calculations are now integrated in the POOL calculations
Partial Order Optimum Likelihood (POOL)
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If you have any trouble with these please email us with your questions or errors.
Molecular Modeling & Molecular Dynamics
YASARA
Homology modeling
YASARA
Electrostatics
MCCE
UHBD
Molecular Visualization
YASARA
CHIMERA
PyMOL
Docking
Schrodinger’s GLIDE
AutoDock (in YASARA)
Servers
DALI
PDBeFold
PASS2
TCOFFEE-EXPRESSO