|
BCL::Conf generates conformational ensembles of small molecules. This server generally supports three modes for conformer generation: (1) Standard - generate a global ensemble starting from the input structure; (2) Generate3D - generate a global ensemble starting from nothing (ignores all input coordinate information); (3) Local - generate a local ensemble starting from the input structure. Users may request a maximum of 250 conformers per ensemble. A maximum of 100 molecules may be submitted at a time, additional molecules will be ignored.
|
Files are limited to 4MB in size; if you are a Meiler-Lab member, please login to upload files up to 16MB
|
|
*
|
|
|
*
|
|
|
|
*
|
|
|
 |
|
|
 |
|
|
 |
|
|
|