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Application

Discovery Studio 0.8958120531154239 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.060459492140266025 Amorphous Cell 0.26844014510278114 Blends 0.0 CASTEP 0.2756952841596131 CDOCKER 0.1487303506650544 CHARMm 0.24909310761789602 COMPASS 0.343409915356711 COMPASS III 0.11608222490931076 COSMObase 0.0036275695284159614 COSMOconf 0.007255139056831923 COSMOperm 0.0 COSMOplex 0.0 COSMOtherm 0.07013301088270858 Catalyst 0.0761789600967352 Classical Simulations 1.0 Conformers 0.0 Crystallization 0.08585247883917775 DFTB Plus 0.007255139056831923 DMol3 0.14268440145102781 DPD 0.0024183796856106408 Discover 0.0036275695284159614 Forcite 0.5392986698911729 GULP 0.016928657799274487 Kinetix 0.0 LUDI 0.0012091898428053204 LibDock 0.06529625151148731 LigandFit 0.0012091898428053204 MODELER 0.22370012091898428 Mesocite 0.0024183796856106408 Mesoscale 0.0036275695284159614 Morphology 0.020556227327690448 ONETEP 0.0 Polymorph 0.0024183796856106408 Quantum Mechanics 0.41233373639661425 Reflex 0.0592503022974607 Reflex Plus 0.0 Semi-empirical 0.007255139056831923 Sorption 0.06892382103990327 Synthia 0.0 Visualization 0.6275695284159613 X-Cell 0.0012091898428053204 ZDOCK 0.02781136638452237

Year

2025 0.8494525547445255 2026 1.0 2027 0.0

Keywords

target 1.0 potential 0.267162471395881 analysis 0.20022883295194507 docking 0.18421052631578946 visualization 0.12929061784897025 between 0.10411899313501144 promising 0.08466819221967964 novel 0.07951945080091533 energy 0.07437070938215103 binding 0.07036613272311212 performance 0.05034324942791762 cell 0.04004576659038902 stability 0.028604118993135013 strategy 0.028604118993135013 activity 0.02803203661327231 strong 0.02745995423340961 including 0.02517162471395881 mechanism 0.01887871853546911 enhanced 0.015446224256292907 therapeutic 0.012585812356979404 effective 0.006864988558352402 development 0.006292906178489702 experimental 0.005720823798627002 efficient 0.0 synthesized 0.0
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