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Application

Discovery Studio 0.7615546218487395 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0958904109589041 Amorphous Cell 0.25280199252801994 Blends 0.0024906600249066002 CASTEP 0.33748443337484435 CDOCKER 0.11955168119551682 CHARMm 0.22914072229140722 COMPASS 0.3711083437110834 COMPASS III 0.0921544209215442 COSMObase 0.007471980074719801 COSMOconf 0.008717310087173101 COSMOmic 0.0 COSMOperm 0.0024906600249066002 COSMOplex 0.0 COSMOquick 0.0037359900373599006 COSMOtherm 0.14819427148194272 Catalyst 0.0958904109589041 Classical Simulations 1.0 Conformers 0.0012453300124533001 Crystallization 0.07970112079701121 DFTB Plus 0.009962640099626401 DMol3 0.17559153175591533 DPD 0.0024906600249066002 Discover 0.0062266500622665 Forcite 0.5317559153175592 GULP 0.024906600249066 LUDI 0.008717310087173101 LibDock 0.06351183063511831 LigandFit 0.0024906600249066002 MCSS 0.0012453300124533001 MODELER 0.19427148194271482 MesoDyn 0.0 Mesocite 0.0024906600249066002 Mesoscale 0.0062266500622665 Morphology 0.0112079701120797 ONETEP 0.0 Polymorph 0.0024906600249066002 QMERA 0.0 QSAR 0.0 Quantum Mechanics 0.5031133250311333 Reflex 0.06351183063511831 Reflex Plus 0.0 Semi-empirical 0.0136986301369863 Sorption 0.0448318804483188 TURBOMOLE 0.0 VAMP 0.0012453300124533001 Visualization 0.5691158156911582 X-Cell 0.0 ZDOCK 0.0062266500622665

Year

2023 0.0 2024 0.4790356394129979 2025 1.0 2026 0.6467505241090147

Keywords

chemical 1.0 target 0.916289592760181 potential 0.27319004524886875 analysis 0.20192307692307693 docking 0.18495475113122173 between 0.17590497737556562 visualization 0.1074660633484163 energy 0.09332579185520362 novel 0.08144796380090498 experimental 0.07861990950226244 promising 0.07013574660633484 including 0.06447963800904978 performance 0.05429864253393665 binding 0.04920814479638009 stability 0.04468325791855204 cell 0.03676470588235294 effective 0.026583710407239818 development 0.023755656108597284 activity 0.019230769230769232 synthesized 0.01809954751131222 strong 0.016402714932126698 design 0.015271493212669683 mechanism 0.006787330316742082 interaction 0.003393665158371041 synthesis 0.0
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