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Application

Discovery Studio 1.0 Materials Studio 0.011166730843280709 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.007306226175349428 Amorphous Cell 0.004129606099110546 CASTEP 0.0028589580686149934 CDOCKER 0.12515883100381195 CHARMm 0.29764930114358323 COMPASS 0.009212198221092757 COMPASS III 0.0025412960609911056 COSMOconf 0.0 COSMOperm 9.529860228716646E-4 COSMOquick 6.353240152477764E-4 COSMOtherm 0.01238881829733164 Catalyst 0.17693773824650572 Classical Simulations 0.32083862770012705 Conformers 0.0 Crystallization 9.529860228716646E-4 DFTB Plus 0.0 DMol3 0.005717916137229987 Forcite 0.014612452350698857 GULP 3.176620076238882E-4 Kinetix 0.0 LUDI 0.009847522236340533 LibDock 0.0403430749682338 LigandFit 0.013341804320203304 MCSS 0.0015883100381194409 MODELER 0.22712833545108005 Morphology 3.176620076238882E-4 Polymorph 0.0 QSAR 9.529860228716646E-4 Quantum Mechanics 0.008894536213468869 Reflex 0.0 Semi-empirical 3.176620076238882E-4 Sorption 0.0015883100381194409 TURBOMOLE 0.0 VAMP 0.0 Visualization 1.0 ZDOCK 0.021918678526048285

Year

2018 0.0390625 2019 0.11484375 2020 0.1890625 2021 0.50078125 2022 0.634375 2023 0.86171875 2024 1.0 2025 0.76171875 2026 0.0

Keywords

silico 1.0 target 0.9689975107490383 docking 0.6329486309119711 visualization 0.4980764878931885 potential 0.47001584068793845 analysis 0.2978049332428151 vitro 0.27494908350305497 binding 0.25616655351889567 activity 0.18510975333785926 protein 0.16225390359809913 drug 0.15071283095723015 novel 0.12514143471373615 inhibition 0.09504412763068568 compound 0.07875084860828242 promising 0.06743607150939127 interaction 0.0540846345326997 synthesis 0.036886173342385156 synthesized 0.03213396696085087 between 0.029418420457116994 treatment 0.029418420457116994 therapeutic 0.026702873953383117 potent 0.016293279022403257 binding affinity 0.007015161801312514 development 0.0036207286716451684 human 0.0
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