|
LigBuilder
V3(20) |
Free for all |
http://repharma.pku.edu.cn/ligbuilder3/ |
|
NAOMInext(21) |
Free for academic |
http://uhh.de/naomi |
|
PINGUI(22) |
Web application |
www.kolblab.org/scubidoo/pingui |
|
de novoDOCK(23) |
Free for academic |
https://dock.compbio.ucsf.edu/ |
|
AutoT&T
2(24) |
300 USD for academic; |
http://www.sioc-ccbg.ac.cn/software/att2/ |
| 3000 USD for industrial |
|
OpenGrowth(25) |
Free for all |
http://opengrowth.sourceforge.net/ |
|
Frag4Lead(27) |
Not public |
N/A |
|
LeadOp+R(28) |
Not public |
N/A |
|
AutoCouple(29) |
Unknown |
Scripts available at https://github.com/Caflisch-Group/AutoCouple_Python-based
|
|
Dock_GA(36) |
Free for academic |
https://dock.compbio.ucsf.edu/ |
|
SECSE(37) |
Open source |
https://github.com/KeenThera/SECSE |
|
EMGA(38) |
Not public |
N/A |
|
Steinmann et al.(39) |
Open source |
https://github.com/cstein/GB-GA/tree/feature-glide_docking |
|
AutoGrow4(35) |
Open source |
https://durrantlab.pitt.edu/autogrow4/ |
|
MoleGear(40) |
Not public |
N/A |
|
Oglic et al.(15) |
Not public |
N/A |
|
DiffSBDD(54) |
Open source |
https://github.com/arneschneuing/DiffSBDD |
|
RELATION(55) |
Unknown |
https://github.com/micahwang/RELATION |
|
Ragoza et al.(56) |
Open source |
https://github.com/mattragoza/liGAN |
|
DeepLigBuilder(57) |
Not public |
N/A |
|
SBMolGen(58) |
Open source |
https://github.com/clinfo/SBMolGen |
|
MolAICal(59) |
Free for academic |
https://molaical.github.io/ |
|
Xu et al.(60) |
Not public |
N/A |
|
DEVELOP(61) |
Open source |
https://github.com/oxpig/DEVELOP |
|
LiGANN(62) |
Web application |
https://playmolecule.com/LiGANN/ |
|
Armstrong et al.(63) |
Not public |
N/A |
|
Grechishnikova et al.(64) |
Unknown |
https://github.com/dariagrechishnikova/molecule_structure_generation |
|
cMolGPT(65) |
Unknown |
https://github.com/VV123/cMolGPT |
|
Luo et al.(66) |
Open source |
https://github.com/luost26/3D-Generative-SBDD |
