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Application

Discovery Studio 0.7383766745468873 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05778648383937316 Amorphous Cell 0.2933398628795299 Blends 0.002448579823702253 CASTEP 0.30166503428011754 CDOCKER 0.1366307541625857 CHARMm 0.2149853085210578 COMPASS 0.3643486777668952 COMPASS III 0.12438785504407443 COSMObase 0.004407443682664055 COSMOconf 0.007345739471106758 COSMOmic 0.0 COSMOperm 4.897159647404506E-4 COSMOplex 4.897159647404506E-4 COSMOtherm 0.06856023506366307 Catalyst 0.06268364348677767 Classical Simulations 1.0 Conformers 4.897159647404506E-4 Crystallization 0.07884427032321253 DFTB Plus 0.0034280117531831538 DMol3 0.14152791380999022 DPD 0.0014691478942213516 Discover 0.0034280117531831538 Forcite 0.5602350636630754 GULP 0.014201762977473066 Kinetix 0.0 LUDI 9.794319294809011E-4 LibDock 0.05337904015670911 LigandFit 0.002938295788442703 MODELER 0.1890303623898139 Mesocite 0.004407443682664055 Mesoscale 0.0053868756121449556 Morphology 0.017140058765915768 ONETEP 9.794319294809011E-4 Polymorph 0.002448579823702253 QMERA 0.0 Quantum Mechanics 0.4373163565132223 Reflex 0.05778648383937316 Reflex Plus 0.0 Semi-empirical 0.004407443682664055 Sorption 0.06513222331047992 Synthia 9.794319294809011E-4 TURBOMOLE 0.0 VAMP 0.0 Visualization 0.5612144955925563 X-Cell 0.0014691478942213516 ZDOCK 0.023016650342801176

Year

2024 0.0 2025 0.7119661136604306 2026 1.0 2027 0.0035298270384751147

Keywords

target 1.0 potential 0.2888765910348644 analysis 0.20863309352517986 docking 0.1701715550636414 between 0.14305478693967902 visualization 0.12866629773104593 energy 0.09324847814056447 promising 0.09020475926950747 novel 0.07719977863862756 performance 0.07360265633646929 cell 0.07028223574986164 binding 0.04537908135030437 stability 0.04095185390149419 strategy 0.03431101272827892 strong 0.03431101272827892 enhanced 0.03126729385722191 activity 0.02545655783065855 including 0.02324294410625346 mechanism 0.017985611510791366 effective 0.012728278915329275 experimental 0.011898173768677366 development 0.00996126175982291 design 0.0063641394576646375 synthesized 5.534034311012728E-4 efficient 0.0
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