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Application

Discovery Studio 1.0 Materials Studio 0.8940766550522649 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.052770448548812667 Amorphous Cell 0.26649076517150394 Blends 0.0021987686895338612 CASTEP 0.27308707124010556 CDOCKER 0.18117854001759015 CHARMm 0.2862796833773087 COMPASS 0.3311345646437995 COMPASS III 0.11257695690413369 COSMObase 0.00395778364116095 COSMOconf 0.006596306068601583 COSMOmic 0.0 COSMOperm 4.3975373790677223E-4 COSMOplex 4.3975373790677223E-4 COSMOtherm 0.06156552330694811 Catalyst 0.07695690413368514 Classical Simulations 1.0 Conformers 4.3975373790677223E-4 Crystallization 0.07167985927880387 DFTB Plus 0.0030782761653474055 DMol3 0.1284080914687775 DPD 0.0013192612137203166 Discover 0.0030782761653474055 Forcite 0.5101143359718557 GULP 0.013192612137203167 Kinetix 0.0 LUDI 0.002638522427440633 LibDock 0.07343887423043095 LigandFit 0.003518029903254178 MODELER 0.2642919964819701 Mesocite 0.00395778364116095 Mesoscale 0.004837291116974494 Morphology 0.0158311345646438 ONETEP 8.795074758135445E-4 Polymorph 0.0021987686895338612 QMERA 0.0 Quantum Mechanics 0.39621811785400174 Reflex 0.052330694810905895 Reflex Plus 0.0 Semi-empirical 0.0043975373790677225 Sorption 0.058927000879507474 Synthia 8.795074758135445E-4 TURBOMOLE 0.0 VAMP 4.3975373790677223E-4 Visualization 0.7084432717678101 X-Cell 0.0013192612137203166 ZDOCK 0.031222515391380826

Year

2024 0.010124873439082012 2025 1.0 2026 0.9622004724940938 2027 0.0

Keywords

target 1.0 potential 0.33786539768864715 docking 0.2465443009290732 analysis 0.23385452073419444 visualization 0.1765239066394743 between 0.13052345343303876 promising 0.0997054158169046 novel 0.09517335146159075 binding 0.0881486517108543 energy 0.058690233401314296 activity 0.05665080444142307 cell 0.05597099478812599 stability 0.041241785633355996 strong 0.03535010197144799 including 0.033537276229322455 performance 0.03263086335825969 development 0.01880806707455246 therapeutic 0.01563562202583277 effective 0.015409018808067075 mechanism 0.01495581237253569 enhanced 0.011783367323815998 strategy 0.010650351234987537 synthesized 0.009290731928393383 protein 0.002266032177656923 interaction 0.0
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