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Application

Discovery Studio 1.0 Materials Studio 0.7422284317149843 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.04752376188094047 Amorphous Cell 0.2586293146573287 Blends 0.0010005002501250625 CASTEP 0.2546273136568284 CDOCKER 0.2046023011505753 CHARMm 0.3231615807903952 COMPASS 0.30965482741370687 COMPASS III 0.11255627813906953 COSMObase 0.00400200100050025 COSMOconf 0.007503751875937969 COSMOmic 0.0 COSMOperm 5.002501250625312E-4 COSMOplex 5.002501250625312E-4 COSMOtherm 0.060030015007503754 Catalyst 0.08754377188594298 Classical Simulations 1.0 Conformers 5.002501250625312E-4 Crystallization 0.06953476738369184 DFTB Plus 0.003501750875437719 DMol3 0.11555777888944473 DPD 0.0015007503751875938 Discover 0.003501750875437719 Forcite 0.4832416208104052 GULP 0.011005502751375688 Kinetix 0.0 LUDI 0.0030015007503751876 LibDock 0.08254127063531766 LigandFit 0.00400200100050025 MODELER 0.2976488244122061 Mesocite 0.00400200100050025 Mesoscale 0.0050025012506253125 Morphology 0.016008004002001 ONETEP 0.0010005002501250625 Polymorph 0.002001000500250125 Quantum Mechanics 0.3661830915457729 Reflex 0.05002501250625312 Reflex Plus 0.0 Semi-empirical 0.00400200100050025 Sorption 0.058529264632316155 Synthia 0.0010005002501250625 TURBOMOLE 0.0 VAMP 0.0 Visualization 0.7883941970985493 X-Cell 5.002501250625312E-4 ZDOCK 0.03501750875437719

Year

2024 0.010221465076660987 2025 1.0 2026 0.8064735945485519 2027 0.0

Keywords

target 1.0 potential 0.3521643433602348 docking 0.276840303252629 analysis 0.2401565174859379 visualization 0.19760332599657618 between 0.11983370017119101 binding 0.10198092443140132 novel 0.0983125458547322 promising 0.0983125458547322 activity 0.06749816581071166 cell 0.048911714355588165 energy 0.04548789435069699 stability 0.03864025434091465 including 0.03570555147957936 strong 0.03374908290535583 therapeutic 0.028857911469797017 development 0.02103203717290291 effective 0.016874541452677916 protein 0.014673514306676448 performance 0.014184397163120567 synthesized 0.010271460014673514 mechanism 0.009293225727561751 strategy 0.0046466128637808754 interaction 0.0034238200048911714 inhibition 0.0
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