See how TorchLite integrates with Torch

TorchLite
Torch
Load protein-ligand crystal structures to visualize favorable interactions
Load up to 10,000 molecules and convert them into 3D so 2D and 3D structures can be viewed side by side
Load results of a ligand or protein based virtual screening experiment
Study SAR of congeneric series by manually modifying structures and visualizing the change in the electrostatic and shape characteristics of the molecules
Activity Miner
Option
Align and compare molecules using a common substructure or using electrostatic and shape characteristics
Gain immediate feedback on new designs using the ‘score while you draw’ feature
Automatically create energetically reasonable conformations for new designs and ensure these can bind to your target
Score new molecules against detailed 3D QSAR models from Cresset’s Forge software
Optimize more than potency with the optional StarDrop module to predict off-target effects
Virtual screen of 500 molecules