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Application

Discovery Studio 0.9646697388632872 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06336665591744599 Amorphous Cell 0.2834569493711706 Blends 0.0019348597226701064 CASTEP 0.3514995162850693 CDOCKER 0.16268945501451146 CHARMm 0.2560464366333441 COMPASS 0.3500483714930668 COMPASS III 0.10141889712995808 COSMObase 0.0043534343760077395 COSMOconf 0.005482102547565301 COSMOmic 1.6123831022250886E-4 COSMOperm 0.001128668171557562 COSMOplex 1.6123831022250886E-4 COSMOquick 0.0012899064817800709 COSMOtherm 0.06610770719122863 Catalyst 0.08916478555304741 Classical Simulations 1.0 Conformers 3.224766204450177E-4 Crystallization 0.0709448564979039 DFTB Plus 0.0043534343760077395 DMol3 0.1581747823282812 DPD 0.002096098032892615 Discover 0.003547242824895195 Forcite 0.5366010964205095 GULP 0.02128345694937117 Kinetix 1.6123831022250886E-4 LUDI 0.003386004514672686 LibDock 0.0691712350854563 LigandFit 0.00419219606578523 MCSS 3.224766204450177E-4 MODELER 0.24040632054176073 MesoDyn 8.061915511125443E-4 Mesocite 0.0025798129635601417 Mesoscale 0.0051596259271202835 Modules 0.0 Morphology 0.01725249919380845 ONETEP 8.061915511125443E-4 Polymorph 0.0019348597226701064 QMERA 1.6123831022250886E-4 QSAR 8.061915511125443E-4 Quantum Mechanics 0.5 Reflex 0.0509513060303128 Reflex Plus 0.001128668171557562 Semi-empirical 0.005965817478232828 Sorption 0.057239600128990646 Synthia 0.0014511447920025798 TURBOMOLE 3.224766204450177E-4 VAMP 0.001128668171557562 Visualization 0.7307320219284101 X-Cell 0.0014511447920025798 ZDOCK 0.02837794259916156

Year

2023 0.06475358702432939 2024 0.4746101060511541 2025 1.0 2026 0.5298814722395508 2027 0.0

Keywords

target 1.0 potential 0.2953792895845876 docking 0.21169476219145095 analysis 0.20650210716435882 visualization 0.17203491872366045 between 0.15149006622516556 novel 0.09760686333534016 energy 0.08263094521372667 promising 0.0768362432269717 binding 0.0679560505719446 cell 0.0632901866345575 activity 0.048916315472606865 stability 0.03845574954846478 performance 0.038380493678506926 including 0.020093317278747743 synthesized 0.019792293798916314 experimental 0.019641782059000603 development 0.016782059000602048 effective 0.016631547260686334 mechanism 0.015653220951234198 interaction 0.015577965081276339 enhanced 0.006773028296207104 protein 0.0038380493678506922 strong 6.773028296207104E-4 design 0.0
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