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Application

Discovery Studio 1.0 Materials Studio 0.8197424892703863 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06126482213438735 Amorphous Cell 0.2628458498023715 Blends 0.0032938076416337285 CASTEP 0.30303030303030304 CDOCKER 0.19104084321475626 CHARMm 0.31357048748353095 COMPASS 0.3227931488801054 COMPASS III 0.1007905138339921 COSMObase 0.003952569169960474 COSMOconf 0.003952569169960474 COSMOperm 6.587615283267457E-4 COSMOquick 0.0 COSMOtherm 0.055994729907773384 Catalyst 0.07905138339920949 Classical Simulations 1.0 Conformers 0.0 Crystallization 0.06719367588932806 DFTB Plus 0.0 DMol3 0.12779973649538867 DPD 0.002635046113306983 Discover 0.005928853754940711 Forcite 0.4894598155467721 GULP 0.011198945981554678 LUDI 0.00461133069828722 LibDock 0.07575757575757576 LigandFit 0.0032938076416337285 MODELER 0.28129117259552044 Mesocite 0.003952569169960474 Mesoscale 0.005928853754940711 Morphology 0.01383399209486166 ONETEP 0.0 Polymorph 0.001976284584980237 QMERA 0.0 QSAR 0.0 Quantum Mechanics 0.4235836627140975 Reflex 0.05006587615283267 Reflex Plus 0.0 Semi-empirical 0.0013175230566534915 Sorption 0.048748353096179184 Synthia 0.0 TURBOMOLE 0.0 VAMP 0.0 Visualization 0.7687747035573123 X-Cell 0.0013175230566534915 ZDOCK 0.03557312252964427

Year

2024 0.23394004282655245 2025 1.0 2026 0.952355460385439 2027 0.0

Keywords

target 1.0 potential 0.3367246471939613 docking 0.27404003938299965 analysis 0.2408926813258943 visualization 0.19100754840827042 between 0.12930751558910403 binding 0.10502133245815556 novel 0.10272399081063341 promising 0.1017394158188382 activity 0.0672792911060059 cell 0.05382343288480473 stability 0.04496225795864785 energy 0.04332129963898917 strong 0.037085658024286185 including 0.024286183130948474 effective 0.01870692484410896 performance 0.01870692484410896 development 0.018050541516245487 therapeutic 0.013455858221201182 enhanced 0.012471283229405973 synthesized 0.011486708237610764 protein 0.008861174926156876 mechanism 0.00590744995077125 interaction 0.004594683295044306 design 0.0
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