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Application

Discovery Studio 1.0 Materials Studio 0.8171670515781371 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.04909560723514212 Amorphous Cell 0.26356589147286824 Blends 5.167958656330749E-4 CASTEP 0.2625322997416021 CDOCKER 0.18708010335917313 CHARMm 0.29819121447028424 COMPASS 0.32506459948320415 COMPASS III 0.10801033591731266 COSMObase 0.004651162790697674 COSMOconf 0.008268733850129198 COSMOmic 0.0 COSMOperm 0.0 COSMOplex 5.167958656330749E-4 COSMOquick 5.167958656330749E-4 COSMOtherm 0.0640826873385013 Catalyst 0.08165374677002583 Classical Simulations 1.0 Conformers 0.0 Crystallization 0.07441860465116279 DFTB Plus 0.004134366925064599 DMol3 0.12454780361757106 DPD 0.0020671834625322996 Discover 0.0036175710594315244 Forcite 0.4997416020671835 GULP 0.013436692506459949 Kinetix 0.0 LUDI 0.0036175710594315244 LibDock 0.07545219638242893 LigandFit 0.0031007751937984496 MODELER 0.28837209302325584 Mesocite 0.0031007751937984496 Mesoscale 0.00516795865633075 Morphology 0.01757105943152455 ONETEP 0.0010335917312661498 Polymorph 0.0020671834625322996 QMERA 0.0 Quantum Mechanics 0.3819121447028424 Reflex 0.05219638242894057 Reflex Plus 5.167958656330749E-4 Semi-empirical 0.00516795865633075 Sorption 0.06149870801033592 Synthia 0.0010335917312661498 TURBOMOLE 0.0 VAMP 0.0 Visualization 0.7581395348837209 X-Cell 5.167958656330749E-4 ZDOCK 0.029974160206718347

Year

2024 0.07471698113207548 2025 1.0 2026 0.840754716981132 2027 0.0

Keywords

target 1.0 potential 0.33514774494556765 docking 0.26153447382063244 analysis 0.23898392949714878 visualization 0.18818040435458788 between 0.11897356143079316 promising 0.09875583203732503 binding 0.09694142042509073 novel 0.09305339554173146 activity 0.05780196993260757 energy 0.05054432348367029 cell 0.049766718506998445 stability 0.04302747537584241 including 0.030326594090202177 strong 0.02177293934681182 therapeutic 0.016848107827890098 performance 0.01425609123898393 effective 0.012441679626749611 development 0.010627268014515292 synthesized 0.01010886469673406 mechanism 0.008553654743390357 protein 0.002851218247796786 strategy 0.002592016588906169 enhanced 0.0015552099533437014 interaction 0.0
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