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Application

Discovery Studio 0.9457735247208932 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06312548113933796 Amorphous Cell 0.283679753656659 Blends 0.001924557351809084 CASTEP 0.306774441878368 CDOCKER 0.1581986143187067 CHARMm 0.25635103926096997 COMPASS 0.33987682832948424 COMPASS III 0.10931485758275597 COSMObase 0.004618937644341801 COSMOconf 0.006543494996150885 COSMOmic 0.0 COSMOperm 7.698229407236335E-4 COSMOplex 3.8491147036181676E-4 COSMOquick 3.8491147036181676E-4 COSMOtherm 0.06735950731331794 Catalyst 0.07890685142417245 Classical Simulations 1.0 Conformers 7.698229407236335E-4 Crystallization 0.0800615858352579 DFTB Plus 0.0026943802925327174 DMol3 0.1424172440338722 DPD 0.003079291762894534 Discover 0.004618937644341801 Forcite 0.535796766743649 GULP 0.013471901462663588 Kinetix 0.0 LUDI 0.003849114703618168 LibDock 0.06351039260969978 LigandFit 0.0023094688221709007 MODELER 0.23864511162432642 Mesocite 0.003464203233256351 Mesoscale 0.006158583525789068 Morphology 0.018860662047729022 ONETEP 0.0011547344110854503 Polymorph 0.0011547344110854503 QMERA 0.0 QSAR 0.0 Quantum Mechanics 0.44418783679753654 Reflex 0.05850654349499615 Reflex Plus 3.8491147036181676E-4 Semi-empirical 0.004618937644341801 Sorption 0.056197074672825253 Synthia 7.698229407236335E-4 TURBOMOLE 0.0 VAMP 0.0011547344110854503 Visualization 0.6720554272517321 X-Cell 0.0011547344110854503 ZDOCK 0.02501924557351809

Year

2024 0.18305304010349288 2025 1.0 2026 0.9553686934023286 2027 0.0

Keywords

target 1.0 potential 0.30393885949441507 analysis 0.22359396433470508 docking 0.21712718009014306 visualization 0.1620615324319028 between 0.13834999020184205 promising 0.09171075837742504 novel 0.08210856359004508 binding 0.07348618459729571 energy 0.07093866353125612 cell 0.06643151087595532 performance 0.048206937095825984 activity 0.04683519498334313 stability 0.04644326866549089 strong 0.02390750538898687 including 0.022535763276504018 enhanced 0.018028610621203214 effective 0.01646090534979424 mechanism 0.015285126396237508 strategy 0.014305310601606898 development 0.012541642171271801 synthesized 0.010777973740936704 experimental 0.006662747403488144 design 0.0023515579071134627 interaction 0.0
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