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Application

Discovery Studio 0.8357155461443444 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06275862068965517 Amorphous Cell 0.28574712643678163 Blends 0.0022988505747126436 CASTEP 0.367816091954023 CDOCKER 0.14781609195402298 CHARMm 0.23793103448275862 COMPASS 0.3650574712643678 COMPASS III 0.0967816091954023 COSMObase 0.004367816091954023 COSMOconf 0.004597701149425287 COSMOmic 2.2988505747126436E-4 COSMOperm 0.0011494252873563218 COSMOplex 0.0 COSMOquick 0.0018390804597701149 COSMOtherm 0.06206896551724138 Catalyst 0.08367816091954022 Classical Simulations 1.0 Conformers 6.89655172413793E-4 Crystallization 0.0735632183908046 DFTB Plus 0.004367816091954023 DMol3 0.16620689655172413 DPD 0.0022988505747126436 Discover 0.003908045977011494 Forcite 0.5489655172413793 GULP 0.02528735632183908 Kinetix 0.0 LUDI 0.0016091954022988506 LibDock 0.06413793103448276 LigandFit 0.0034482758620689655 MCSS 0.0 MODELER 0.20850574712643677 MesoDyn 6.89655172413793E-4 Mesocite 0.003218390804597701 Mesoscale 0.005747126436781609 Modules 0.0 Morphology 0.01632183908045977 ONETEP 9.195402298850574E-4 Polymorph 0.002758620689655172 QMERA 0.0 QSAR 4.597701149425287E-4 Quantum Mechanics 0.5218390804597701 Reflex 0.05379310344827586 Reflex Plus 0.001379310344827586 Semi-empirical 0.0052873563218390806 Sorption 0.06 Synthia 0.0011494252873563218 TURBOMOLE 2.2988505747126436E-4 VAMP 4.597701149425287E-4 Visualization 0.672183908045977 X-Cell 0.0016091954022988506 ZDOCK 0.02413793103448276

Year

2023 0.08826619964973731 2024 0.42294220665499127 2025 1.0 2026 0.45183887915936954 2027 0.0

Keywords

target 1.0 potential 0.28890866614751365 analysis 0.20347090888864167 docking 0.1934586717098676 visualization 0.1599733007008566 between 0.157414617866281 novel 0.10101234842585383 energy 0.09978863054844811 promising 0.07598175547891868 cell 0.06863944821448437 binding 0.06352208254533319 performance 0.04950495049504951 stability 0.04271887862943598 activity 0.03949271331627545 experimental 0.02747802870174658 interaction 0.024140616308821892 including 0.023250639670708645 synthesized 0.022694404271887864 effective 0.022360663032595395 mechanism 0.017910779842029146 development 0.01690955612415174 enhanced 0.0057848481477361215 design 0.0031149182333963733 protein 3.337412392924686E-4 strong 0.0
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