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Application

Discovery Studio 1.0 Materials Studio 0.8452149791955618 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05296064729680029 Amorphous Cell 0.26406767193821257 Blends 0.0018389113644722325 CASTEP 0.2762044869437293 CDOCKER 0.18646561235748438 CHARMm 0.29937477013607944 COMPASS 0.32548731151158516 COMPASS III 0.10776020595807283 COSMObase 0.004045605001838912 COSMOconf 0.005884516366311144 COSMOmic 0.0 COSMOperm 3.677822728944465E-4 COSMOplex 3.677822728944465E-4 COSMOquick 3.677822728944465E-4 COSMOtherm 0.05847738139021699 Catalyst 0.07980875321809489 Classical Simulations 1.0 Conformers 3.677822728944465E-4 Crystallization 0.07318867230599485 DFTB Plus 0.0033100404560500183 DMol3 0.12945936005884517 DPD 0.0018389113644722325 Discover 0.004045605001838912 Forcite 0.5038617138653917 GULP 0.01360794409709452 Kinetix 0.0 LUDI 0.004781169547627804 LibDock 0.07686649503493932 LigandFit 0.004045605001838912 MODELER 0.28429569694740714 Mesocite 0.0033100404560500183 Mesoscale 0.004781169547627804 Morphology 0.016182420007355647 ONETEP 7.35564545788893E-4 Polymorph 0.0025744759102611253 QMERA 3.677822728944465E-4 Quantum Mechanics 0.3997793306362633 Reflex 0.05296064729680029 Reflex Plus 7.35564545788893E-4 Semi-empirical 0.004781169547627804 Sorption 0.06031629275468922 Synthia 7.35564545788893E-4 TURBOMOLE 0.0 VAMP 3.677822728944465E-4 Visualization 0.734828981243104 X-Cell 0.001471129091577786 ZDOCK 0.03126149319602795

Year

2024 0.10883190883190884 2025 1.0 2026 0.9207977207977208 2027 0.0

Keywords

target 1.0 potential 0.33846442650647646 docking 0.25642951004317627 analysis 0.236718603341468 visualization 0.18021400412990426 between 0.12896564670546273 promising 0.09592641261498029 binding 0.09348601464238783 novel 0.09217195419560728 activity 0.05500281584381453 cell 0.05331330955509668 energy 0.051436080345410175 stability 0.0377323071146987 including 0.02797071522432889 strong 0.026468931856579687 performance 0.01989862962267693 development 0.01351605030974282 effective 0.012389712783930917 mechanism 0.00788436268068331 therapeutic 0.006570302233902759 synthesized 0.006007133470996809 enhanced 0.004317627182278956 protein 0.0037544584193730055 interaction 9.386146048432514E-4 strategy 0.0
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