| Projects menu |
 |
Open project |
 |
Download all project items in a compressed file, that can be restored back to NAFlex |
 |
Delete project from the workspace (all items will be deleted). |
| Data types |
 |
PDB Structure |
 |
PDB Structure + PSF Topology (NAMD format). |
 |
PDB Structure + PARMTop Topology (AMBER format). |
 |
PDB Structure + Top (& ITPs) Topology (GROMACS format). |
 |
MD Trajectory. |
 |
MD Trajectory CRD Amber ASCII format. |
 |
MD Trajectory DCD CHARMM/X-PLOR/NAMD Binary format. |
 |
MD Trajectory XTC Gromacs Binary format. |
 |
MD Trajectory NetCDF (Network Common Data Form), machine-independent binary data format for array-oriented scientific data. |
 |
MD Trajectory compressed with Pcazip, using Principal Component Analysis (PCA) algorithms. |
 |
Amino Acid sequence with an associated feature value as an array of real vaues (e.g. Bfactor x residue). |
 |
Data as an XY array (e.g. RMSd vs time) |
 |
Nucleic Acid Flexibility Analysis |
| Data status |
 |
Data computed and stored correctly. |
 |
Data not yet available, process is still running. |
 |
Data not available, process has failed. |
| Operations |
 |
Quick info about the operation. |
 |
Perform a new setup operation on the selected structure. |
 |
Perform a new simulation/optimization procedure. |
 |
Perform a new analysis. |
 |
Visualize structure using Rasmol compatibles viewers (plug-in required). |
 |
Visualize structure using JMol. |
 |
Download object in a compressed tgz file. |
 |
View log file. |
 |
Delete item from the workspace. |