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Application

Discovery Studio 1.0 Materials Studio 0.9988344988344988 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.066407629812787 Amorphous Cell 0.2790533380430943 Blends 0.0017661603673613563 CASTEP 0.33663016601907453 CDOCKER 0.17273048392794066 CHARMm 0.2744613210879548 COMPASS 0.34758036029671496 COMPASS III 0.09042741080890145 COSMObase 0.0035323207347227126 COSMOconf 0.006004945249028612 COSMOperm 0.0 COSMOquick 0.0017661603673613563 COSMOtherm 0.06358177322500883 Catalyst 0.0762981278700106 Classical Simulations 1.0 Conformers 0.0 Crystallization 0.06817379018014835 DFTB Plus 0.006004945249028612 DMol3 0.14270575768279758 DPD 0.0031790886612504416 Discover 0.0021193924408336277 Forcite 0.5337336630166019 GULP 0.020487460261391734 Kinetix 0.0 LUDI 0.003885552808194984 LibDock 0.07170611091487107 LigandFit 0.0035323207347227126 MODELER 0.2673966796185094 MesoDyn 0.001412928293889085 Mesocite 0.002472624514305899 Mesoscale 0.007064641469445425 Modules 0.0 Morphology 0.015188979159307664 ONETEP 3.5323207347227127E-4 Polymorph 0.0010596962204168139 QSAR 7.064641469445425E-4 Quantum Mechanics 0.4697986577181208 Reflex 0.04980572235959025 Reflex Plus 0.0010596962204168139 Semi-empirical 0.007417873542917697 Sorption 0.050865418580007066 Synthia 0.0010596962204168139 TURBOMOLE 3.5323207347227127E-4 VAMP 0.0010596962204168139 Visualization 0.684916990462734 X-Cell 0.0017661603673613563 ZDOCK 0.028611797951253973

Year

2025 0.0

Keywords

target 1.0 potential 0.31434121074781485 docking 0.21333764972483005 analysis 0.20734865652314666 visualization 0.15021042408546456 between 0.1490773713175785 novel 0.09630948527031402 promising 0.08918743930074458 binding 0.07882809970864357 energy 0.07429588863709939 cell 0.061994172871479444 activity 0.04791194561346714 stability 0.04370346390417611 including 0.03900938815150534 performance 0.03123988345742959 interaction 0.023470378763353835 development 0.019909355778569116 strong 0.01764325024279702 effective 0.016833926837164132 experimental 0.01602460343153124 synthesized 0.011977986403366786 mechanism 0.011816121722240207 enhanced 0.009064422143088379 therapeutic 0.005503399158303658 protein 0.0
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