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Application

Discovery Studio 1.0 Materials Studio 0.8045007032348804 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.051978277734678044 Amorphous Cell 0.26415826221877425 Blends 7.757951900698216E-4 CASTEP 0.2746314972847168 CDOCKER 0.1978277734678045 CHARMm 0.31225756400310317 COMPASS 0.3157486423584174 COMPASS III 0.11016291698991466 COSMObase 0.00504266873545384 COSMOconf 0.0062063615205585725 COSMOmic 0.0 COSMOperm 3.878975950349108E-4 COSMOplex 3.878975950349108E-4 COSMOquick 7.757951900698216E-4 COSMOtherm 0.05973622963537626 Catalyst 0.08766485647788984 Classical Simulations 1.0 Conformers 3.878975950349108E-4 Crystallization 0.06943366951124903 DFTB Plus 0.0034910783553141972 DMol3 0.13033359193173003 DPD 0.0023273855702094647 Discover 0.004266873545384018 Forcite 0.49534522885958104 GULP 0.013576415826221877 Kinetix 0.0 LUDI 0.0031031807602792862 LibDock 0.07796741660201707 LigandFit 0.004266873545384018 MODELER 0.287044220325834 Mesocite 0.003878975950349108 Mesoscale 0.005430566330488751 Morphology 0.01590380139643134 ONETEP 0.0011636927851047323 Polymorph 0.0023273855702094647 QMERA 0.0 Quantum Mechanics 0.399922420480993 Reflex 0.04965089216446858 Reflex Plus 7.757951900698216E-4 Semi-empirical 0.004266873545384018 Sorption 0.05818463925523662 Synthia 7.757951900698216E-4 TURBOMOLE 0.0 VAMP 0.0 Visualization 0.7660977501939488 X-Cell 7.757951900698216E-4 ZDOCK 0.03180760279286268

Year

2024 0.15905147484094853 2025 1.0 2026 0.8270676691729323 2027 0.0

Keywords

target 1.0 potential 0.33555006650199504 docking 0.26258787763632907 analysis 0.2365570967129014 visualization 0.18810564316929507 between 0.12882386471594148 promising 0.09310279308379252 binding 0.09006270188105643 novel 0.08968269048071442 activity 0.06004180125403762 energy 0.05662169865095953 cell 0.054341630248907466 stability 0.03458103743112293 including 0.029830894926847807 strong 0.02147064411932358 performance 0.016530495914877447 synthesized 0.0148204446133384 development 0.013870416112483375 effective 0.012920387611628349 therapeutic 0.011970359110773323 protein 0.010450313509405283 mechanism 0.0060801824054721645 interaction 0.002660079802394072 strategy 0.0022800684020520615 enhanced 0.0
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