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Application

Discovery Studio 1.0 Materials Studio 0.9581077229980052 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06382592928377154 Amorphous Cell 0.2766999093381686 Blends 0.001813236627379873 CASTEP 0.3354487760652765 CDOCKER 0.17026291931097007 CHARMm 0.2794197642792384 COMPASS 0.3399818676337262 COMPASS III 0.09483227561196736 COSMObase 0.004351767905711695 COSMOconf 0.005258386219401632 COSMOmic 0.0 COSMOperm 7.252946509519493E-4 COSMOplex 1.8132366273798732E-4 COSMOquick 0.0016319129646418858 COSMOtherm 0.06291931097008159 Catalyst 0.09374433363553944 Classical Simulations 1.0 Conformers 1.8132366273798732E-4 Crystallization 0.06835902085222122 DFTB Plus 0.004170444242973708 DMol3 0.15485040797824115 DPD 0.0019945602901178605 Discover 0.0038077969174977336 Forcite 0.5223934723481415 GULP 0.017951042611060744 Kinetix 0.0 LUDI 0.0038077969174977336 LibDock 0.071441523118767 LigandFit 0.004170444242973708 MCSS 5.439709882139619E-4 MODELER 0.24895738893925656 MesoDyn 5.439709882139619E-4 Mesocite 0.0034451495920217587 Mesoscale 0.005621033544877607 Morphology 0.015593834995466908 ONETEP 7.252946509519493E-4 Polymorph 0.0019945602901178605 QMERA 1.8132366273798732E-4 QSAR 7.252946509519493E-4 Quantum Mechanics 0.48087035358114233 Reflex 0.04968268359020852 Reflex Plus 7.252946509519493E-4 Semi-empirical 0.005621033544877607 Sorption 0.052221214868540346 Synthia 7.252946509519493E-4 TURBOMOLE 3.6264732547597464E-4 VAMP 9.066183136899365E-4 Visualization 0.7512239347234814 X-Cell 0.0016319129646418858 ZDOCK 0.028830462375339982

Year

2023 0.07389304197814836 2024 0.46520989074180563 2025 1.0 2026 0.5875503162737206 2027 0.0

Keywords

target 1.0 potential 0.3047895500725689 docking 0.22940322718347136 analysis 0.21249893280969862 visualization 0.17894646973448305 between 0.1460770084521472 novel 0.09638862802014855 binding 0.07641082557841715 promising 0.07538632288909758 energy 0.07214206437291898 cell 0.05779902672244515 activity 0.048151626398019294 stability 0.03611371979851447 performance 0.025612567232988985 including 0.021173055579270895 synthesized 0.01639204302911295 effective 0.014769913771023649 interaction 0.014684538546913685 development 0.012379407495944676 experimental 0.010159651669085631 mechanism 0.009391274652095962 protein 0.00776914539400666 enhanced 0.0015367540339793393 strong 0.0015367540339793393 synthesis 0.0
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