Tags · docking / ocladock · GitLab

Tags give the ability to mark specific points in history as being important

sd-tsri Steepest-descent done at TSRI.

389c51af · added commandline option to choose localsearchmethod · Apr 25, 2018

Release sd-tsri

Rotations in shoemake representation + gradient calculation + steepest-descent (additional to Solis-Wets). Developed at TSRI.

Download source code

zip tar.gz tar.bz2 tar
iwocl-2017

93199dc1 · correction torsion-tsri · Mar 29, 2018

Release iwocl-2017

In Proceedings at IWOCL 2017.

Download source code

zip tar.gz tar.bz2 tar