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Application

Discovery Studio 1.0 Materials Studio 0.9134355275022543 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.057791834387579066 Amorphous Cell 0.277458309373203 Blends 0.0020126509488211618 CASTEP 0.30937320299022425 CDOCKER 0.17567567567567569 CHARMm 0.2866589994249569 COMPASS 0.3312248418631397 COMPASS III 0.1046578493387004 COSMObase 0.00488786658999425 COSMOconf 0.00718803910293272 COSMOmic 0.0 COSMOperm 5.750431282346176E-4 COSMOplex 2.875215641173088E-4 COSMOquick 8.625646923519264E-4 COSMOtherm 0.0655549166187464 Catalyst 0.078205865439908 Classical Simulations 1.0 Conformers 2.875215641173088E-4 Crystallization 0.06900517538815411 DFTB Plus 0.0023001725129384704 DMol3 0.14203565267395055 DPD 0.0011500862564692352 Discover 0.004312823461759632 Forcite 0.511213341000575 GULP 0.01696377228292122 Kinetix 0.0 LUDI 0.004600345025876941 LibDock 0.07446808510638298 LigandFit 0.0040253018976423235 MCSS 2.875215641173088E-4 MODELER 0.27314548591144333 MesoDyn 5.750431282346176E-4 Mesocite 0.0031627372052903968 Mesoscale 0.00488786658999425 Morphology 0.016101207590569294 ONETEP 5.750431282346176E-4 Polymorph 0.0017251293847038527 QMERA 0.0 QSAR 5.750431282346176E-4 Quantum Mechanics 0.4427832087406556 Reflex 0.05031627372052904 Reflex Plus 0.0 Semi-empirical 0.0040253018976423235 Sorption 0.05491661874640598 Synthia 8.625646923519264E-4 TURBOMOLE 0.0 VAMP 0.0011500862564692352 Visualization 0.719666474985624 X-Cell 0.0011500862564692352 ZDOCK 0.03105232892466935

Year

2024 0.26328718177757926 2025 1.0 2026 0.7849486377847253 2027 0.0

Keywords

target 1.0 potential 0.3230769230769231 docking 0.23853211009174313 analysis 0.22117148906139733 visualization 0.16908962597035992 between 0.13817925194071984 novel 0.09569513055751588 promising 0.08990825688073395 binding 0.08567395906845449 energy 0.06365561044460127 cell 0.05688073394495413 activity 0.0492589978828511 stability 0.039378969654199014 performance 0.0273817925194072 including 0.025688073394495414 strong 0.020465772759350742 development 0.014255469301340862 effective 0.014114326040931546 mechanism 0.010021171489061398 synthesized 0.008186309103740297 enhanced 0.006069160197600565 interaction 0.003952011291460833 protein 0.0019760056457304165 experimental 0.0012702893436838392 therapeutic 0.0
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