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Application

Discovery Studio 1.0 Materials Studio 0.6395306197286396 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0817011751538892 Amorphous Cell 0.1119194180190263 Blends 5.595970900951316E-4 CASTEP 0.2753217683268047 CDOCKER 0.18130945719082261 CHARMm 0.24790151091214327 COMPASS 0.22831561275881365 COMPASS III 0.041969781757134866 COSMObase 0.0 COSMOconf 0.0 COSMOmic 0.0 COSMOperm 5.595970900951316E-4 COSMOquick 5.595970900951316E-4 COSMOtherm 0.02238388360380526 Catalyst 0.2417459429210968 Classical Simulations 0.7347509792949076 Conformers 0.0 Crystallization 0.09681029658645775 DFTB Plus 0.002238388360380526 DMol3 0.11415780637940683 DPD 0.0 Discover 0.0 Forcite 0.3374370453273643 GULP 0.010072747621712367 LUDI 0.004476776720761052 LibDock 0.05987688864017907 LigandFit 0.0027979854504756574 MCSS 0.001119194180190263 MODELER 0.1012870733072188 MesoDyn 0.0 Mesocite 0.001119194180190263 Mesoscale 0.002238388360380526 Morphology 0.011751538891997761 QSAR 5.595970900951316E-4 Quantum Mechanics 0.38668158925573587 Reflex 0.0833799664241746 Reflex Plus 0.001119194180190263 Semi-empirical 0.0027979854504756574 Sorption 0.03469501958589815 Synthia 0.001119194180190263 TURBOMOLE 0.0 VAMP 0.0 Visualization 1.0 X-Cell 0.0027979854504756574 ZDOCK 0.00391717963066592

Year

2020 0.0 2021 0.14742335290280495 2022 0.22113502935420742 2023 0.4116112198303979 2024 0.87279843444227 2025 1.0 2026 0.3470319634703196 2027 6.523157208088715E-4

Keywords

synthesized 1.0 target 0.9580976863753213 docking 0.36838046272493574 synthesis 0.3609254498714653 potential 0.28174807197943447 visualization 0.2766066838046273 novel 0.2665809768637532 compound 0.18046272493573265 analysis 0.15784061696658097 activity 0.14190231362467867 binding 0.10282776349614396 promising 0.09588688946015424 design 0.0699228791773779 between 0.06812339331619537 vitro 0.06478149100257069 potent 0.061439588688946015 inhibition 0.061182519280205655 designed 0.0596401028277635 experimental 0.02030848329048843 silico 0.02030848329048843 cell 0.01696658097686375 effective 0.015938303341902313 active 0.013881748071979434 drug 0.007712082262210797 development 0.0
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