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Application

Discovery Studio 1.0 Materials Studio 0.8645887899423782 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0546767537826685 Amorphous Cell 0.26478679504814306 Blends 0.0017193947730398899 CASTEP 0.28198074277854196 CDOCKER 0.18638239339752408 CHARMm 0.29745529573590096 COMPASS 0.32599724896836313 COMPASS III 0.10832187070151307 COSMObase 0.004814305364511692 COSMOconf 0.005502063273727648 COSMOmic 0.0 COSMOperm 3.43878954607978E-4 COSMOplex 3.43878954607978E-4 COSMOquick 6.87757909215956E-4 COSMOtherm 0.05983493810178817 Catalyst 0.08321870701513068 Classical Simulations 1.0 Conformers 3.43878954607978E-4 Crystallization 0.06980742778541953 DFTB Plus 0.003094910591471802 DMol3 0.13651994497936726 DPD 0.0020632737276478678 Discover 0.003782668500687758 Forcite 0.5058459422283357 GULP 0.014786795048143054 Kinetix 0.0 LUDI 0.0034387895460797797 LibDock 0.07462173314993123 LigandFit 0.003782668500687758 MODELER 0.27579092159559837 Mesocite 0.003782668500687758 Mesoscale 0.00515818431911967 Morphology 0.015474552957359009 ONETEP 0.0010316368638239339 Polymorph 0.002407152682255846 QMERA 3.43878954607978E-4 Quantum Mechanics 0.4126547455295736 Reflex 0.05055020632737277 Reflex Plus 6.87757909215956E-4 Semi-empirical 0.004470426409903714 Sorption 0.05742778541953233 Synthia 6.87757909215956E-4 TURBOMOLE 0.0 VAMP 3.43878954607978E-4 Visualization 0.732806052269601 X-Cell 0.001375515818431912 ZDOCK 0.029917469050894086

Year

2024 0.1656708310700706 2025 1.0 2026 0.9082020640956002 2027 0.0

Keywords

target 1.0 potential 0.33275352235171335 docking 0.2515220038267525 analysis 0.23482344755609671 visualization 0.17707427378674553 between 0.13237084710384414 promising 0.0935814924334667 novel 0.08766742042094278 binding 0.08488432770916682 energy 0.05566185423551922 cell 0.053922421290659245 activity 0.052530874934771266 stability 0.034440772308227514 including 0.025917550878413638 strong 0.020873195338319706 performance 0.020351365454861714 development 0.010610540963645852 effective 0.010262654374673856 synthesized 0.009218994607757871 mechanism 0.0052182988345799266 protein 0.003478865889719951 therapeutic 0.003478865889719951 enhanced 0.0022612628283179685 interaction 1.7394329448599757E-4 strategy 0.0
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