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2) Edit and save omega.parm (using the same name) in your favorite editor. An example of omega.parm is shown at the bottom of this page. Settings you may want to consider changing are:

[[Portal:Erice2010 | return to main workshop page]]

Note: this page was adapted from https://sites.google.com/site/dock37wiki/home/analyzing-do

This is the page you see immediately after pressing the "DOCK" button. Your data are uploade

For all the following examples ''you'' is the user’s name that needs the ssh key and anything italicized is an example or comment (ju Create a folder “ssh-stuff” (or whatever name makes sense to you to store you ssh keys in) in Computer -> Local Disk (C:)

Fields are the column name of the catalog: Optional: Price, Compound Name, CAS

→ back to [[Dock Users' Meeting Minutes (DUMM)|DUMM main page]]

...ational pharmacology and computer aided drug discovery is a big deal. This page is part of a series of articles called [[So you want to set up a lab]]. He

This is the Wiki Page for '''DUD-E''' or (we like to call "DUDE"), a '''D'''irectory of '''U'''se This page contains documentation, FAQ, and may be used for posting errors and omissio

...king.org/activities.txt:gene.name?activities.affinitynm:ge=8&distinct=gene.name&count=all http://zincapi.ucsf.bkslab.org/v1/activities/txt:target.gene.name,substance.smiles,substance.zinc_id,substance.purchasability/activity.affini

Note that +19 is the lowest priority possible. Consult the man page for more information. Here the 3 represents idle. Consult the man page for other options such as -c 2 which has different priority levels for best

This page maps ZINC22 numbering. ZINC numbers are built as follows:

...to run the visualizer directly from smiles and fingerprints, see bottom of page. activity_name = "Emax" # The text name of the activity (in this case, Emax)

...an search by the treatment type and trial phase from their advanced search page: ...nfo: CTI (Clinical Trials Insight) published by ADIS ( http://www.adis.com/page.asp?ObjectID=26); and TrialTrove published by CiteLine (http://www.citeline

Parent page: [[SynthI]]

This is a page to keep track of errata we've found with the ChEMBL database at [https://ww

:Required packages installed as per page :/etc/hosts configured to have fully resolved name:

This page describes simple protocols for receptor/active site and ligand minimization

As of the writing of this page, the latest version of Tomcat 9 is 9.0.30

```THIS PAGE IS CURRENTLY WIP``` ...es, single thread model that subdock currently uses. See further down this page for more details).