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Application

Discovery Studio 0.9057331863285557 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06930445647646814 Amorphous Cell 0.2816326530612245 Blends 0.0025822573927530195 CASTEP 0.41391087047063724 CDOCKER 0.15943356934610578 CHARMm 0.24223240316534778 COMPASS 0.3779258642232403 COMPASS III 0.07680133277800916 COSMObase 0.003082049146189088 COSMOconf 0.0035818408996251563 COSMOmic 1.665972511453561E-4 COSMOperm 0.0011661807580174927 COSMOplex 3.331945022907122E-4 COSMOquick 0.001582673885880883 COSMOtherm 0.06505622657226155 Cantera 8.329862557267805E-5 Catalyst 0.11328613077884214 Classical Simulations 1.0 Conformers 0.0011661807580174927 Crystallization 0.07805081216159933 DFTB Plus 0.0060807996668054975 DMol3 0.19133694294044148 DPD 0.0029154518950437317 Discover 0.0047480216576426485 Forcite 0.5434402332361516 GULP 0.027238650562265723 Kinetix 2.4989587671803414E-4 LUDI 0.004914618908788005 LibDock 0.06613910870470638 LigandFit 0.006164098292378176 MCSS 0.0012494793835901709 MODELER 0.18050812161599333 MesoDyn 0.001749271137026239 Mesocite 0.003998334027488546 Mesoscale 0.007496876301541024 Modules 0.0 Morphology 0.018408996251561848 ONETEP 0.0011661807580174927 Polymorph 0.001999167013744273 QMERA 2.4989587671803414E-4 QSAR 0.0013327780091628488 Quantum Mechanics 0.592253227821741 Reflex 0.0573094543940025 Reflex Plus 8.329862557267805E-4 Semi-empirical 0.008329862557267805 Sorption 0.05722615576842982 Synthia 0.001665972511453561 TURBOMOLE 5.830903790087463E-4 VAMP 0.0018325697625989172 Visualization 0.8007496876301541 X-Cell 0.0012494793835901709 ZDOCK 0.027488546438983758

Year

2020 0.0 2021 0.1102348405187522 2022 0.1518576936558009 2023 0.4575008762705924 2024 0.842534174553102 2025 1.0 2026 0.3731160182264283 2027 6.133894146512443E-4

Keywords

target 1.0 potential 0.26030242302787393 docking 0.19883403169976316 visualization 0.1910366186919293 analysis 0.17751867371105848 between 0.15518309345964656 novel 0.09458917835671343 energy 0.09007105119329568 binding 0.06103115321552195 cell 0.059027145199489886 promising 0.04714884314082711 activity 0.04230278739296776 interaction 0.03406813627254509 experimental 0.030570231371834577 stability 0.02845691382765531 performance 0.02525050100200401 synthesized 0.024412461286208782 mechanism 0.016760794315904538 effective 0.015485516487520496 development 0.014319548187283659 protein 0.010202222627072327 including 0.009109127345600291 synthesis 0.006339952632537803 chemical 0.0014938968846784479 design 0.0
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