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Application

Discovery Studio 1.0 Materials Studio 0.8646616541353384 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0516359918200409 Amorphous Cell 0.26789366053169733 Blends 5.112474437627812E-4 CASTEP 0.2658486707566462 CDOCKER 0.18047034764826175 CHARMm 0.28629856850715746 COMPASS 0.331799591002045 COMPASS III 0.10991820040899795 COSMObase 0.004601226993865031 COSMOconf 0.0081799591002045 COSMOmic 0.0 COSMOperm 0.0 COSMOplex 5.112474437627812E-4 COSMOquick 5.112474437627812E-4 COSMOtherm 0.06492842535787322 Catalyst 0.08742331288343558 Classical Simulations 1.0 Conformers 0.0 Crystallization 0.07515337423312883 DFTB Plus 0.00408997955010225 DMol3 0.12934560327198363 DPD 0.002044989775051125 Discover 0.0035787321063394683 Forcite 0.5086912065439673 GULP 0.013803680981595092 Kinetix 0.0 LUDI 0.003067484662576687 LibDock 0.07208588957055215 LigandFit 0.003067484662576687 MODELER 0.27862985685071573 Mesocite 0.003067484662576687 Mesoscale 0.005112474437627812 Morphology 0.01789366053169734 ONETEP 0.0010224948875255625 Polymorph 0.002044989775051125 QMERA 0.0 Quantum Mechanics 0.39008179959100203 Reflex 0.05265848670756646 Reflex Plus 5.112474437627812E-4 Semi-empirical 0.005112474437627812 Sorption 0.061860940695296525 Synthia 0.0010224948875255625 TURBOMOLE 0.0 VAMP 0.0 Visualization 0.7239263803680982 X-Cell 5.112474437627812E-4 ZDOCK 0.02607361963190184

Year

2024 0.24293286219081273 2025 1.0 2026 0.9991166077738516 2027 0.0

Keywords

target 1.0 potential 0.32684319833852543 docking 0.2497403946002077 analysis 0.23598130841121495 visualization 0.17471443406022846 between 0.12824506749740394 promising 0.09215991692627207 novel 0.08904465212876428 binding 0.08073727933541018 energy 0.05685358255451713 cell 0.0563343717549325 activity 0.05114226375908619 stability 0.03115264797507788 including 0.022585669781931463 synthesized 0.018691588785046728 performance 0.01791277258566978 strong 0.01142263759086189 effective 0.010643821391484943 development 0.007528556593977154 strategy 0.005451713395638629 protein 0.005192107995846314 mechanism 0.003894080996884735 therapeutic 0.0028556593977154725 enhanced 0.0012980269989615785 synthesis 0.0
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