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Application

Discovery Studio 0.8179696616102684 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06340057636887608 Amorphous Cell 0.29394812680115273 Blends 0.0019212295869356388 CASTEP 0.3078770413064361 CDOCKER 0.14265129682997119 CHARMm 0.22910662824207492 COMPASS 0.3559077809798271 COMPASS III 0.11815561959654179 COSMObase 0.0038424591738712775 COSMOconf 0.0067243035542747355 COSMOmic 0.0 COSMOperm 9.606147934678194E-4 COSMOplex 4.803073967339097E-4 COSMOquick 0.0 COSMOtherm 0.06628242074927954 Catalyst 0.06724303554274735 Classical Simulations 1.0 Conformers 4.803073967339097E-4 Crystallization 0.08309317963496637 DFTB Plus 0.002881844380403458 DMol3 0.1378482228626321 DPD 0.002881844380403458 Discover 0.004803073967339097 Forcite 0.5537944284341979 GULP 0.012487992315081652 Kinetix 0.0 LUDI 0.0019212295869356388 LibDock 0.06099903938520653 LigandFit 0.0019212295869356388 MODELER 0.21085494716618636 Mesocite 0.004322766570605188 Mesoscale 0.0067243035542747355 Morphology 0.018731988472622477 ONETEP 9.606147934678194E-4 Polymorph 0.001440922190201729 QMERA 0.0 Quantum Mechanics 0.4404418828049952 Reflex 0.06099903938520653 Reflex Plus 4.803073967339097E-4 Semi-empirical 0.004322766570605188 Sorption 0.060038424591738714 Synthia 9.606147934678194E-4 TURBOMOLE 0.0 VAMP 4.803073967339097E-4 Visualization 0.611911623439001 X-Cell 9.606147934678194E-4 ZDOCK 0.024015369836695485

Year

2025 0.8750460744563214 2026 1.0 2027 0.0

Keywords

target 1.0 potential 0.3075919645186538 analysis 0.22306287503261152 docking 0.19775632663709888 visualization 0.15366553613357684 between 0.14088181581007045 promising 0.09809548656404905 novel 0.08844247325854422 energy 0.08557265849204279 cell 0.07852856770153926 performance 0.0693973388990347 binding 0.06522306287503261 stability 0.05426558831202713 activity 0.045656144012522826 strong 0.039394729976519695 strategy 0.034437777198017216 enhanced 0.033394208192016696 including 0.03261153143751631 mechanism 0.025045656144012524 effective 0.021393164623010698 development 0.019306026611009653 design 0.014609966084007305 synthesized 0.013305504826506652 experimental 0.01121836681450561 interaction 0.0
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