123 | | - Got scripts from Phil Cruz |
124 | | - Joined GitHub repository for scripts setup by Philip Macmenamin, 2-factor authentication |
| 123 | - Joined GitHub repository for scripts setup by Philip Macmenamin, 2-factor authentication; seems that 2FA wil not be a problem for our day-to-day work |
| 124 | - Got 3 scripts from Phil Cruz |
| 125 | - Eric: the 2 shorter scripts are in good shape, few issues: |
| 126 | - ChimeraX does not write VRML; not absolute requirement, can convert glb to vrml in separate step |
| 127 | - ChimeraX "graphics quality" can be used to adjust numbers of triangles for STL output |
| 128 | - no incremental radius adjustment a la Chimera vdwdefine plus/minus; Eric will supply python to do this |
| 129 | - no combine, why was it used? Phil: to handle biological assemblies that were multiple models. Eric: now the fetch gets the assemblies as single models |
| 130 | - Philip asks about taking all the file reading and branching out of the ChimeraX scripts and instead have several separate ChimeraX scripts that are called; however, parsing with ChimeraX has several advantages |
| 131 | - Phil: actually may want to combine small-molecule and macromolecule scripts into one to reduce user error; distinction is presence of "standard residues" (biopolymer chains) |
| 132 | - Darrell: how about also combining with volume script, have ChimeraX identify if upload is map? Eric: should be doable, at least if filename has standard suffix |
| 133 | - Darrell: will also need to distinguish which database goes with an identifier for fetch purposes |
| 134 | - Phil: if REST, is a hybrid approach possible? |
| 135 | - Eric improved error reporting in JSON |