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Application

Discovery Studio 0.8733668341708543 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.053763440860215055 Amorphous Cell 0.2801672640382318 Blends 0.0011947431302270011 CASTEP 0.28136200716845877 CDOCKER 0.14755077658303464 CHARMm 0.23954599761051373 COMPASS 0.34647550776583036 COMPASS III 0.12783751493428913 COSMObase 0.0035842293906810036 COSMOconf 0.008960573476702509 COSMOmic 0.0 COSMOperm 5.973715651135006E-4 COSMOplex 5.973715651135006E-4 COSMOtherm 0.06750298685782556 Catalyst 0.07108721624850657 Classical Simulations 1.0 Conformers 5.973715651135006E-4 Crystallization 0.08004778972520908 DFTB Plus 0.0035842293906810036 DMol3 0.12843488649940263 DPD 0.0017921146953405018 Discover 0.004181600955794504 Forcite 0.551373954599761 GULP 0.011350059737156512 Kinetix 0.0 LUDI 0.0011947431302270011 LibDock 0.061529271206690564 LigandFit 0.0023894862604540022 MODELER 0.2120669056152927 Mesocite 0.0047789725209080045 Mesoscale 0.005973715651135006 Morphology 0.018518518518518517 ONETEP 0.0011947431302270011 Polymorph 0.0017921146953405018 Quantum Mechanics 0.4056152927120669 Reflex 0.05794504181600956 Reflex Plus 0.0 Semi-empirical 0.004181600955794504 Sorption 0.06332138590203107 Synthia 0.0011947431302270011 TURBOMOLE 0.0 VAMP 0.0 Visualization 0.6230585424133811 X-Cell 5.973715651135006E-4 ZDOCK 0.025089605734767026

Year

2025 0.8310049571879224 2026 1.0 2027 0.0

Keywords

target 1.0 potential 0.2947605271616843 analysis 0.20893603342976536 docking 0.1951141112182578 visualization 0.1452909032465445 between 0.1285760205721633 promising 0.08550305368048859 novel 0.07682417229186757 energy 0.07103825136612021 cell 0.060109289617486336 binding 0.0585020893603343 performance 0.052073288331726135 stability 0.038894246223079396 activity 0.0353584056573449 strong 0.03342976534876246 strategy 0.029572484731597556 including 0.024429443908711025 enhanced 0.01575056252009 mechanism 0.010286081645773062 effective 0.008678881388621022 therapeutic 0.007393121182899389 development 0.007071681131468981 synthesized 0.0019286403085824494 experimental 0.0012857602057216328 design 0.0
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