DeepPurpose.oneliner.virtual_screening

text:todo

def virtual_screening(
                target,
                X_repurpose = None,
                target_name = None,
                drug_names = None,
                train_drug = None,
                train_target = None,
                train_y = None,
                save_dir = './save_folder',
                pretrained_dir = None,
                finetune_epochs = 10,
                finetune_LR = 0.01,
                finetune_batch_size = 32,
                convert_y = True,
                subsample_frac = 1,
                pretrained = True,
                split = 'random',
                frac = [0.7,0.1,0.2],
                agg = 'agg_mean_max',
                output_len = 30):