Fpsim2

Latest version: v0.5.2

Safety actively analyzes 688803 Python packages for vulnerabilities to keep your Python projects secure.

Page 3 of 6

* quicker (~30%) db file creation.

* C++ code tidy up -> tiny (~10%) speedup. Compiling with a modern clang and skylake arch -> ~30% speedup.

* fixed bug in FPSim2Cuda intorduced in previous release (need to figure out how to test for CUDA)

* added support for sdf.gz files, thanks greglandrum

* fixed bug affecting when generating fp dbs with size multiple of 10k, thanks adalke

- command-line tools and chemfp compatibility. Thanks to adalke

fix engine in_memory_fps and fps_sort params

Experimental CUDA searches support, new documentation available.

Has known vulnerabilities

Previous Next