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Application

Discovery Studio 1.0 Materials Studio 0.12494912494912495 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.01777434312210201 Amorphous Cell 0.04868624420401855 Blends 7.727975270479134E-4 CASTEP 0.06027820710973725 CDOCKER 0.22102009273570325 CHARMm 0.3740340030911901 COMPASS 0.07727975270479134 COMPASS III 0.00927357032457496 COSMOperm 7.727975270479134E-4 COSMOtherm 0.01313755795981453 Catalyst 0.14683153013910355 Classical Simulations 0.5200927357032458 Crystallization 0.013910355486862442 DFTB Plus 0.0015455950540958269 DMol3 0.027820710973724884 DPD 0.0015455950540958269 Forcite 0.09814528593508501 GULP 0.0061823802163833074 LUDI 0.005409582689335394 LibDock 0.09814528593508501 LigandFit 0.0061823802163833074 MCSS 0.00231839258114374 MODELER 0.35394126738794435 MesoDyn 7.727975270479134E-4 Mesocite 0.0 Mesoscale 0.0030911901081916537 Morphology 0.0030911901081916537 ONETEP 0.0 Quantum Mechanics 0.08809891808346214 Reflex 0.010046367851622875 Semi-empirical 0.00231839258114374 Sorption 0.0077279752704791345 TURBOMOLE 0.0 VAMP 0.0 Visualization 1.0 ZDOCK 0.04173106646058733

Year

2024 0.0

Keywords

target 1.0 docking 0.49383802816901406 potential 0.4097711267605634 visualization 0.36971830985915494 analysis 0.2636443661971831 binding 0.2011443661971831 novel 0.13556338028169015 protein 0.13556338028169015 activity 0.12632042253521128 between 0.08714788732394366 vitro 0.06602112676056338 silico 0.058538732394366196 promising 0.05237676056338028 compound 0.05193661971830986 drug 0.04929577464788732 therapeutic 0.04709507042253521 interaction 0.04357394366197183 synthesis 0.04005281690140845 treatment 0.04005281690140845 inhibition 0.021566901408450703 development 0.014084507042253521 including 0.013644366197183098 synthesized 0.013204225352112676 effective 0.005721830985915493 modeler 0.0
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