Closed danielparton closed 9 years ago
Modeller dependency is now installed via conda.
Modeller
Fixed bug in package_for_fah. Also, function now uses renumbered topologies if available, and only outputs a single system and integrator file for each target
package_for_fah
Awesome! +1000
jchodera
commented
9 years ago
Modellerdependency is now installed via conda.Fixed bug in
package_for_fah. Also, function now uses renumbered topologies if available, and only outputs a single system and integrator file for each target