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Application

Discovery Studio 1.0 Materials Studio 0.9695508164332617 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06826700693835235 Amorphous Cell 0.27554031421963476 Blends 0.00279129117154478 CASTEP 0.4076880133981976 CDOCKER 0.17632985086530026 CHARMm 0.2602280883643034 COMPASS 0.3715607305207752 COMPASS III 0.07504585692638967 COSMObase 0.003030544700534333 COSMOconf 0.0035090517585134383 COSMOmic 2.392535289895526E-4 COSMOperm 0.0013557699976074647 COSMOplex 3.190047053194035E-4 COSMOquick 0.0015152723502671664 COSMOtherm 0.06316293165324188 Cantera 0.0 Catalyst 0.12680437036446288 Classical Simulations 1.0 Conformers 9.570141159582104E-4 Crystallization 0.07552436398436876 DFTB Plus 0.005662333519419411 DMol3 0.18677725496451072 DPD 0.0032697982295238856 Discover 0.004545817050801499 Forcite 0.530983332004147 GULP 0.026477390541510486 Kinetix 2.392535289895526E-4 LUDI 0.005263577637770157 LibDock 0.07193556104952548 LigandFit 0.007177605869686578 MCSS 0.0011165164686179122 MODELER 0.18805327378578834 MesoDyn 0.0015950235265970174 Mesocite 0.004466065874471649 Mesoscale 0.008054868809314938 Modules 0.0 Morphology 0.017306005263577638 ONETEP 0.001276018821277614 Polymorph 0.0019140282319164209 QMERA 2.392535289895526E-4 QSAR 0.001276018821277614 Quantum Mechanics 0.5825025919132307 Reflex 0.05590557460722546 Reflex Plus 7.177605869686578E-4 Semi-empirical 0.0076561129276656835 Sorption 0.054789058138607544 Synthia 0.0014355211739373157 TURBOMOLE 4.785070579791052E-4 VAMP 0.0015950235265970174 Visualization 0.8886673578435282 X-Cell 0.001276018821277614 ZDOCK 0.031023207592311988

Year

2020 0.004638543672326274 2021 0.1408191843164712 2022 0.296166637493436 2023 0.41449326098372136 2024 0.945650271311045 2025 1.0 2026 0.3720462103973394 2027 0.0

Keywords

target 1.0 potential 0.2643427497819231 docking 0.2175400925988056 visualization 0.21354760786418842 analysis 0.17922565926323558 between 0.15111051466147757 novel 0.09893981077635375 energy 0.08055425082198216 binding 0.06985170770985707 cell 0.05656579212239146 activity 0.05166744950681071 promising 0.044856740253640205 interaction 0.03861638596255788 synthesized 0.027309937596457088 stability 0.027209286720794472 experimental 0.02673958263436892 protein 0.019056565792122393 mechanism 0.017077098570757565 effective 0.016171240689794 development 0.015567335435818291 performance 0.014929879889955042 synthesis 0.012413607998389586 including 0.008421123263772395 design 4.361537945380125E-4 chemical 0.0
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